SCHEMBL23087698

SCHEMBL23087698

Cc1ccc(-c2c(Br)cnn2C)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 1/20 0.41
XBP1 P17861 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
HTR2A P28223 3/20 0.40
PDE2A O00408 6/20 0.39
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 1/20 0.39
AKT1 P31749 2/20 0.37
HTR2C P28335 1/20 0.35
PTGS2 P35354 1/20 0.34
CYP11B2 P19099 1/20 0.34

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
SCHEMBL3489027 0.83 HTR2A (0.45) HTR2APDE2APRMT5WDR77AKT1
SCHEMBL9933261 0.83 HTR2A (0.54) HTR2APDE2APRMT5WDR77AKT1
SCHEMBL3562130 0.82 HTR2A (0.47) NPC1RAB9AALDH1A1MAPTHTT
SCHEMBL23087462 0.81 HTR2A (0.46) NPC1RAB9AMAPTSMN1; SMN2HTR2A
SCHEMBL4137079 0.81 BRAF (0.42) MAPTHTR2AAKT1HTR2C
Ammonia Solution, Strong SCHEMBL6202263 0.81 HTR2A (0.46) NPC1RAB9AALDH1A1MAPTHTT
SCHEMBL23087266 0.80 PTK2 (0.45) HTR2APDE2APRMT5WDR77AKT1
SCHEMBL23087470 0.80 PRMT5 (0.42) NPC1RAB9AHTR2APDE2APRMT5
SCHEMBL23087750 0.80 HTR2A (0.50) RAB9AMAPTSMN1; SMN2HTR2APDE2A
SCHEMBL14996666 0.80 PDE2A (0.41) NPC1RAB9APDE2APRMT5WDR77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240208912-A1 MTA-Cooperative PRMT5 Inhibitors MIRATI THERAPEUTICS INC (US) 2024-06-27 US disclosed
US-20230054883-A1 MTA-Cooperative PRMT5 Inhibitors Mirati Therapeutics, Inc. 2023-02-23 US disclosed
US-20230054883-A1 MTA-Cooperative PRMT5 Inhibitors Mirati Therapeutics, Inc. 2023-02-23 US disclosed
US-11492351-B2 MTA-cooperative PRMT5 inhibitors Mirati Therapeutics, Inc. (US) 2022-11-08 US disclosed
US-11479551-B2 MTA-cooperative PRMT5 inhibitors Mirati Therapeutics, Inc. (US) 2022-10-25 US disclosed
US-11479551-B2 MTA-cooperative PRMT5 inhibitors Mirati Therapeutics, Inc. (US) 2022-10-25 US disclosed
US-20210078994-A1 MTA-Cooperative PRMT5 Inhibitors Mirati Therapeutics, Inc. 2021-03-18 US disclosed
US-20210078994-A1 MTA-Cooperative PRMT5 Inhibitors Mirati Therapeutics, Inc. 2021-03-18 US disclosed
US-20210079003-A1 MTA-Cooperative PRMT5 Inhibitors Mirati Therapeutics, Inc. 2021-03-18 US disclosed
US-20210079003-A1 MTA-Cooperative PRMT5 Inhibitors Mirati Therapeutics, Inc. 2021-03-18 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 (6 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-11479551-B2 MTA-cooperative PRMT5 inhibitors PRMT5, PRMT1, PRMT3 NPC1 1766/4885RAB9A 1505/4885ALDH1A1 4000/4885
US-20240208912-A1 MTA-Cooperative PRMT5 Inhibitors PRMT1, PRMT5, PRMT6 NPC1 2461/4885RAB9A 1994/4885ALDH1A1 3367/4885
US-20210079003-A1 MTA-Cooperative PRMT5 Inhibitors PRMT5, PRMT1, PRMT3 NPC1 1583/4885RAB9A 1606/4885ALDH1A1 4216/4885
US-20210078994-A1 MTA-Cooperative PRMT5 Inhibitors PRMT5, PRMT1, PRMT3 NPC1 1583/4885RAB9A 1606/4885ALDH1A1 4216/4885
US-11492351-B2 MTA-cooperative PRMT5 inhibitors PRMT5, PRMT1, PRMT3 NPC1 1766/4885RAB9A 1505/4885ALDH1A1 4000/4885
US-20230054883-A1 MTA-Cooperative PRMT5 Inhibitors PRMT5, PRMT1, PRMT3 NPC1 1583/4885RAB9A 1606/4885ALDH1A1 4216/4885

“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.