SCHEMBL11330620

SCHEMBL11330620

CCOc1ccc2c(C(N)=O)c(O)c(C(=O)OCCCN3CCCCC3)cc2c1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.47
HRH3 Q9Y5N1 3/20 0.46
KCNH2 Q12809 1/20 0.46
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HTR4 Q13639 1/20 0.45
CYP2D6 P10635 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL11341395 0.86 HRH3 (0.50) HRH3KCNH2KDM4EALDH1A1
SCHEMBL11341383 0.84 HTR4 (0.55) HRH3KDM4EALDH1A1HTR4CYP2D6
SCHEMBL4506214 0.82 HRH3 (0.55) MAOBHRH3KCNH2
SCHEMBL4498814 0.76 MAOB (0.49) MAOBHRH3KDM4EALDH1A1
SCHEMBL11344876 0.76 KDM4E (0.48) HRH3KDM4EALDH1A1TSHR
SCHEMBL4490641 0.74 HRH3 (0.49) MAOBHRH3
SCHEMBL6268708 0.74 KDM4E (0.51) HRH3KDM4EALDH1A1HTR4
SCHEMBL4498291 0.74 NPC1 (0.54) MAOBHRH3KDM4EALDH1A1
SCHEMBL4492506 0.73 HRH3 (0.52) MAOBHRH3KCNH2
SCHEMBL11331256 0.72 ALDH1A1 (0.50) MAOBKDM4EALDH1A1TSHR

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-4304831-A ELECTROGRAPHY; COPIES RICOH CO., LTD. (JP) 1981-12-08 US claimed
US-4304831-A ELECTROGRAPHY; COPIES RICOH CO., LTD. (JP) 1981-12-08 US disclosed
US-4225662-A 5-(ACETOACETAMIDO)BENZIMIDAZOLIN-2-ONE YELLOW COUPLERS RICOH COMPANY, LTD. (JP) 1980-09-30 US disclosed