SCHEMBL10367631

SCHEMBL10367631

Oc1ccc2[nH]nc(NCCCN3CCC(Cl)CC3)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 10/20 0.41
▸ MCHR1 Q99705 2/20 0.41
▸ DYRK1A Q13627 2/20 0.40
▸ CDK2 P24941 1/20 0.40
▸ CDK16 Q00536 1/20 0.40
▸ ACHE P22303 1/20 0.40
▸ CCR2 P41597 2/20 0.39
▸ HTR1A P08908 1/20 0.39
▸ DRD2 P14416 1/20 0.39
▸ HTR1B P28222 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ HTR2C P28335 1/20 0.39
▸ HTR1E P28566 1/20 0.39
▸ HTR1F P30939 1/20 0.39
▸ HTR7 P34969 1/20 0.39
▸ DRD3 P35462 1/20 0.39
▸ HTR2B P41595 1/20 0.39
▸ HTR6 P50406 1/20 0.39
▸ CCR5 P51681 1/20 0.39
▸ CDC7 O00311 1/20 0.39

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
SCHEMBL10371460 0.90 GSK3B (0.40) GSK3BMCHR1DYRK1ACDK2CDK16
SCHEMBL10368910 0.89 CYP2D6 (0.45) GSK3BMCHR1DYRK1ACDK2CDK16
SCHEMBL10370127 0.88 MCHR1 (0.54) MCHR1ACHE
SCHEMBL10370014 0.88 HRH3 (0.43) DYRK1ACDK2HTR7CDC7MAP2K7
SCHEMBL10368034 0.86 HRH3 (0.45) DYRK1AACHEHTR7CDC7
SCHEMBL10368865 0.86 HRH3 (0.45) DYRK1AACHEHTR7CDC7
SCHEMBL10371678 0.84 CDC7 (0.51) DYRK1ACDC7
SCHEMBL10831383 0.84 ACHE (0.56) MCHR1ACHEHTR1ADRD2HTR2A
SCHEMBL10371096 0.82 ACHE (0.44) ACHEMAP2K7
SCHEMBL10370849 0.80 MCHR1 (0.53) MCHR1CDC7

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
EP-0090972-B1 INDAZOLE DERIVATIVES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1990-05-30 — — EP disclosed
US-4533731-A ANTIINFLAMMATORY AGENTS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-08-06 — — US disclosed
EP-0090972-A2 Indazole derivatives Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1983-10-12 — — EP disclosed
Send feedback