SCHEMBL31246336

SCHEMBL31246336

Ic1ccccc1CNc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
HIF1A Q16665 3/20 0.46
MAPT P10636 3/20 0.46
KDM1A O60341 1/20 0.46
TAAR1 Q96RJ0 3/20 0.43
ALDH1A1 P00352 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
IDO1 P14902 1/20 0.42

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
SCHEMBL5179423 1.00 CYP1A2 (0.55) CYP1A2CYP2D6CYP2C9CYP2C19HIF1A
SCHEMBL694154 0.84 CYP1A2 (0.41) CYP1A2CYP2D6CYP2C9CYP2C19HIF1A
SCHEMBL10055008 0.84 MAPT (0.53) CYP1A2CYP2C9CYP2C19HIF1AMAPT
SCHEMBL20897517 0.82 CYP1A2 (0.51) CYP1A2CYP2D6CYP2C9CYP2C19HIF1A
SCHEMBL802584 0.74 HIF1A (0.74) CYP2D6HIF1AMAPTALDH1A1MEN1
SCHEMBL7988500 0.74 RAB9A (0.65) CYP1A2CYP2D6CYP2C9CYP2C19HIF1A
SCHEMBL11513654 0.74 KMT2A (0.72) CYP1A2CYP2D6CYP2C9CYP2C19MAPT
SCHEMBL21799637 0.74 CFD (0.47) HIF1AMAPTALDH1A1MEN1KMT2A
SCHEMBL11080258 0.74 MAPT (0.52) HIF1AMAPTALDH1A1MEN1KMT2A
SCHEMBL8219013 0.74 MAPT (0.50) CYP1A2CYP2C9CYP2C19HIF1AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250261501-A1 LIGHT EMITTING ELEMENT AND METHOD FOR PRODUCING THE SAME, LIGHT EMITTING COMPOUND AND METHOD FOR PRODUCING THE SAME, COMPOSITION AND METHOD FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2025-08-14 US disclosed
EP-4498778-A1 LIGHT-EMITTING ELEMENT AND PRODUCTION METHOD THEREFOR, LIGHT-EMITTING COMPOUND AND PRODUCTION METHOD THEREFOR, COMPOSITION AND PRODUCTION METHOD THEREFOR, INFORMATION PROCESSING METHOD, INFORMATION PROCESSING DEVICE, PROGRAM, METHOD FOR PROVIDING LIGHT-EMITTING COMPOUND, AND DATA GENERATION METHOD Sumitomo Chemical Company, Limited (JP) 2025-01-29 EP disclosed
CN-119014139-A Light-emitting element and method for producing same, light-emitting compound and method for producing same, composition and method for producing same, information processing method, information processing device, computer program product, method for providing light-emitting compound, and method for generating data 住友化学株式会社 2024-11-22 CN disclosed