SCHEMBL24665233

SCHEMBL24665233

COC(=O)c1cccc(-c2ccc(F)cc2)c1C

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A3 Q01959 5/20 0.74
▸ SLC6A4 P31645 3/20 0.74
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ NPC1 O15118 1/20 0.51
▸ CASP3 P42574 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ SENP8 Q96LD8 1/20 0.51
▸ SENP7 Q9BQF6 1/20 0.51
▸ SENP6 Q9GZR1 1/20 0.51
▸ TSHR P16473 3/20 0.48
▸ CYP1A2 P05177 2/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ PDCD1 Q15116 2/20 0.47
▸ CD274 Q9NZQ7 2/20 0.47
▸ SLC6A2 P23975 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ PTGS1 P23219 1/20 0.46

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
SCHEMBL30012190 1.00 SLC6A3 (0.74) SLC6A3SLC6A4SMN1; SMN2NPC1CASP3
SCHEMBL13824149 0.86 SLC6A3 (0.55) SLC6A3SLC6A4SMN1; SMN2NPC1CASP3
SCHEMBL13824199 0.86 SLC6A3 (0.77) SLC6A3SLC6A4SMN1; SMN2NPC1CASP3
SCHEMBL5533081 0.85 PDCD1 (0.60) SLC6A3SLC6A4TSHRPDCD1CD274
SCHEMBL29918042 0.85 PDCD1 (0.60) SLC6A3SLC6A4TSHRPDCD1CD274
SCHEMBL6627614 0.85 SLC6A3 (1.00) SLC6A3SLC6A4SMN1; SMN2NPC1CASP3
SCHEMBL20200106 0.84 KDM4E (0.60) SLC6A3SLC6A4NPC1CYP1A2CYP2D6
SCHEMBL29917415 0.84 SLC6A3 (0.52) SLC6A3SLC6A4PDCD1CD274SLC6A2
SCHEMBL29634134 0.83 TSHR (0.53) SLC6A3SLC6A4SMN1; SMN2RAB9ATSHR
SCHEMBL19849652 0.83 TSHR (0.53) SLC6A3SLC6A4SMN1; SMN2RAB9ATSHR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240246931-A1 COMPOUNDS AS PD1/PD-L1 INHIBITORS AND METHODS THEREOF Jubilant Prodel LLC (US) 2024-07-25 — — US disclosed
EP-4326272-A1 COMPOUNDS AS PD1/PD-L1 INHIBITORS AND METHODS THEREOF Jubilant Prodel LLC (US) 2024-02-28 — — EP disclosed
WO-2022224278-A1 COMPOUNDS AS PD1/PD-L1 INHIBITORS AND METHODS THEREOF Jubilant Prodel LLC (US) 2022-10-27 — — WO disclosed
WO-2022224278-A1 COMPOUNDS AS PD1/PD-L1 INHIBITORS AND METHODS THEREOF Jubilant Prodel LLC (US) 2022-10-27 — — WO 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 (1 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-20240246931-A1 COMPOUNDS AS PD1/PD-L1 INHIBITORS AND METHODS THEREOF CD274, PDCD1, PDCD1LG2 SLC6A3 4372/4885SLC6A4 4854/4885SMN1; SMN2 3618/4885

“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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