SCHEMBL11713798

SCHEMBL11713798

CC(C)N(CCOc1cccc(C(=O)c2ccc(N)c(N)c2)c1)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 5/20 0.45
▸ ESR1 P03372 4/20 0.44
▸ ESR2 Q92731 2/20 0.44
▸ STS P08842 5/20 0.44
▸ LMNA P02545 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ SRD5A2 P31213 1/20 0.43
▸ CHRNB2 P17787 1/20 0.43
▸ CHRNA4 P43681 1/20 0.43
▸ KMT2A Q03164 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
SCHEMBL11716196 0.94 ESR1 (0.44) MCHR1ESR1STSLMNAMAPK1
SCHEMBL11718537 0.93 LMNA (0.44) ESR1LMNAMAPK1L3MBTL1KMT2A
SCHEMBL11722280 0.89 ESR1 (0.53) MCHR1ESR1ESR2LMNAMAPK1
SCHEMBL11714292 0.86 ESR1 (0.54) ESR1STSLMNAMAPK1L3MBTL1
SCHEMBL11714087 0.84 ESR1 (0.57) ESR1LMNAMAPK1L3MBTL1KMT2A
SCHEMBL11712256 0.83 KMT2A (0.48) ESR1LMNAMAPK1L3MBTL1KMT2A
SCHEMBL11720078 0.83 ESR1 (0.55) ESR1LMNAMAPK1L3MBTL1CHRNB2
SCHEMBL11720107 0.83 ESR1 (0.46) MCHR1ESR1ESR2L3MBTL1
SCHEMBL11807252 0.82 CHRNB2 (0.51) MCHR1ESR1ESR2CHRNB2CHRNA4
SCHEMBL11720909 0.82 ALDH1A1 (0.54) ESR1LMNAMAPK1L3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4010272-A ANTHELMINTICALLY ACTIVE BASICALLY SUBSTITUTED 2-CARBALKOXY-AMINO-BENZIMIDAZOLYL-5(6)-PHENYL ETHERS AND -KETONES HOECHST AKTIENGESELLSCHAFT (DT) 1977-03-01 — — US disclosed
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