SCHEMBL11401575

SCHEMBL11401575

Cc1cc(OCc2ccccc2C)ccc1CCC=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.52
▸ CDK4 P11802 2/20 0.52
▸ CCND1 P24385 2/20 0.52
▸ CCNB2 O95067 1/20 0.52
▸ CDK1 P06493 1/20 0.52
▸ CCNB1 P14635 1/20 0.52
▸ CCNB3 Q8WWL7 1/20 0.52
▸ ACHE P22303 1/20 0.49
▸ FFAR1 O14842 5/20 0.46
▸ FFAR4 Q5NUL3 2/20 0.46
▸ SLC26A4 O43511 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.42
▸ ESR1 P03372 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ ESR2 Q92731 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL11388004 0.82 MAOB (0.55) MAOBCDK4CCND1CCNB2CDK1
SCHEMBL67347 0.80 TAAR1 (0.54) CDK4CCND1ACHEKMT2A
SCHEMBL12628533 0.79 FFAR1 (0.71) FFAR1FFAR4
SCHEMBL3519432 0.78 CDK4 (0.56) MAOBCDK4CCND1CCNB2CDK1
SCHEMBL3312341 0.77 KMT2A (0.45) MAOBPOLBKMT2A
SCHEMBL11399612 0.75 MAOB (0.44) MAOBCDK4CCND1CCNB2CDK1
SCHEMBL29502999 0.74 MAOB (0.54) MAOBCDK4CCND1CCNB2CDK1
SCHEMBL18703278 0.74 MAOB (0.54) MAOBCDK4CCND1CCNB2CDK1
SCHEMBL13678723 0.73 POLB (0.35) FFAR1FFAR4ESR1TP53POLB
SCHEMBL498283 0.73 MAOB (0.60) MAOBCDK4CCND1CCNB2CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4262013-A ANTILIPEMIC AGENTS SANKYO COMPANY LIMITED (JP) 1981-04-14 — — US disclosed
US-4198425-A ANTILIPEMIC AGENTS SANKYO COMPANY LIMITED (JP) 1980-04-15 — — US disclosed
Send feedback