SCHEMBL24204592

SCHEMBL24204592

CC(C)c1c(O)cc(-c2cc3ccccc3cn2)cc1OCCCN

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ HTR1B P28222 1/20 0.36
▸ S1PR1 P21453 1/20 0.36
▸ MELK Q14680 1/20 0.35
▸ IDO1 P14902 3/20 0.34
▸ TDO2 P48775 3/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ RPS6KA5 O75582 1/20 0.32
▸ AKT1 P31749 1/20 0.32
▸ RPS6KA1 Q15418 1/20 0.32
▸ ALOX5AP P20292 2/20 0.32
▸ FEN1 P39748 2/20 0.32
▸ TLR8 Q9NR97 1/20 0.32
▸ MIF P14174 1/20 0.31
▸ GRM4 Q14833 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30389777 1.00 NPC1 (0.40) NPC1RAB9AHTR1BS1PR1MELK
Trifluoroacetic Acid SCHEMBL29493151 0.91 CACNA1B (0.40) NPC1RAB9AMELKIDO1TDO2
SCHEMBL26874136 0.90 NPC1 (0.44) NPC1RAB9AS1PR1IDO1TDO2
SCHEMBL30365932 0.82 NPC1 (0.50) NPC1RAB9AIDO1TDO2TDP1
SCHEMBL24204595 0.82 NPC1 (0.50) NPC1RAB9AIDO1TDO2TDP1
SCHEMBL27253067 0.80 — —
SCHEMBL27033328 0.79 NPC1 (0.41) NPC1RAB9AS1PR1IDO1TDO2
SCHEMBL27033433 0.79 NPC1 (0.41) NPC1RAB9AS1PR1IDO1TDO2
SCHEMBL31010855 0.78 NPC1 (0.47) NPC1RAB9AIDO1TDO2ALOX5AP
SCHEMBL29493154 0.78 RAB9A (0.39) NPC1RAB9AS1PR1IDO1TDO2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260069585-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR MEDIATED DISEASES Dermavant Sciences GmbH (CH) 2026-03-12 — — US disclosed
US-20250282730-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE Dermavant Sciences GmbH (CH) 2025-09-11 — — US disclosed
US-12252471-B2 Isoquinoline compounds and their use in treating AhR imbalance Dermavant Sciences GmbH (CH) 2025-03-18 — — US disclosed
US-20240208910-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE Dermavant Sciences GmbH (CH) 2024-06-27 — — US disclosed
US-20240208910-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE Dermavant Sciences GmbH (CH) 2024-06-27 — — US disclosed
US-20240208910-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE Dermavant Sciences GmbH (CH) 2024-06-27 — — US disclosed
WO-2024050434-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR MEDIATED DISEASES Dermavant Sciences GmbH (CH) 2024-03-07 — — WO disclosed
WO-2024050434-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR MEDIATED DISEASES Dermavant Sciences GmbH (CH) 2024-03-07 — — WO disclosed
US-11827605-B2 Isoquinoline compounds and their use in treating AhR imbalance Dermavant Sciences GmbH (CH) 2023-11-28 — — US disclosed
US-11827605-B2 Isoquinoline compounds and their use in treating AhR imbalance Dermavant Sciences GmbH (CH) 2023-11-28 — — US disclosed
US-20230124135-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE Dermavant Sciences GmbH (CH) 2023-04-20 — — US disclosed
US-20230124135-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE Dermavant Sciences GmbH (CH) 2023-04-20 — — US disclosed
US-11548853-B2 Isoquinoline compounds and their use in treating AhR imbalance Dermavant Sciences GmbH (CH) 2023-01-10 — — US disclosed
US-11548853-B2 Isoquinoline compounds and their use in treating AhR imbalance Dermavant Sciences GmbH (CH) 2023-01-10 — — US disclosed
US-20220153703-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE Dermavant Sciences GmbH (CH) 2022-05-19 — — US disclosed
US-20220153703-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE Dermavant Sciences GmbH (CH) 2022-05-19 — — US disclosed
US-11267788-B2 Isoquinoline compounds and their use in treating AhR imbalance Dermavant Sciences GmbH (CH) 2022-03-08 — — US disclosed
US-11267788-B2 Isoquinoline compounds and their use in treating AhR imbalance Dermavant Sciences GmbH (CH) 2022-03-08 — — US disclosed
US-20220017468-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE Dermavant Sciences GmbH (CH) 2022-01-20 — — US disclosed
US-20220017468-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE Dermavant Sciences GmbH (CH) 2022-01-20 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230124135-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE AHR, ARNT, HRH1 NPC1 767/4885RAB9A 2589/4885HTR1B 272/4885
US-12252471-B2 Isoquinoline compounds and their use in treating AhR imbalance AHR, ARNT, HRH1 NPC1 767/4885RAB9A 2589/4885HTR1B 272/4885
US-20250282730-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE AHR, ARNT, HRH1 NPC1 767/4885RAB9A 2589/4885HTR1B 272/4885
US-20220017468-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE AHR, ARNT, HRH1 NPC1 767/4885RAB9A 2589/4885HTR1B 272/4885
US-20260069585-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR MEDIATED DISEASES HRH2, AHR, HRH1 NPC1 1725/4885RAB9A 843/4885HTR1B 2080/4885
US-20220153703-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE AHR, ARNT, HRH1 NPC1 767/4885RAB9A 2589/4885HTR1B 272/4885
US-11827605-B2 Isoquinoline compounds and their use in treating AhR imbalance AHR, ARNT, HRH1 NPC1 767/4885RAB9A 2589/4885HTR1B 272/4885
US-11548853-B2 Isoquinoline compounds and their use in treating AhR imbalance AHR, ARNT, HRH1 NPC1 767/4885RAB9A 2589/4885HTR1B 272/4885
US-20240208910-A1 ISOQUINOLINE COMPOUNDS AND THEIR USE IN TREATING AhR IMBALANCE AHR, ARNT, HRH1 NPC1 767/4885RAB9A 2589/4885HTR1B 272/4885
US-11267788-B2 Isoquinoline compounds and their use in treating AhR imbalance AHR, ARNT, HRH1 NPC1 767/4885RAB9A 2589/4885HTR1B 272/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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