SCHEMBL11214411

SCHEMBL11214411

CC(C)C1CCN(c2ccc(Cl)cc2C(=O)NCCc2ccc(C(=O)O)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ MAPT P10636 4/20 0.43
▸ POLB P06746 2/20 0.43
▸ CXCR3 P49682 2/20 0.43
▸ HPGD P15428 1/20 0.43
▸ DNMT3A Q9Y6K1 1/20 0.43
▸ MCHR1 Q99705 2/20 0.43
▸ TDP1 Q9NUW8 1/20 0.42
▸ CYP2D6 P10635 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ TNKS O95271 1/20 0.41
▸ TNKS2 Q9H2K2 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 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
SCHEMBL11191065 0.89 MAPT (0.54) LMNAMAPK1MAPTPOLBHPGD
SCHEMBL11193056 0.88 MAPT (0.46) LMNAMAPK1MAPTPOLBHPGD
SCHEMBL11182439 0.87 LMNA (0.48) LMNAMAPK1MAPTPOLBHPGD
SCHEMBL11199855 0.87 DNMT3A (0.48) LMNAMAPK1MAPTPOLBHPGD
SCHEMBL11441498 0.86 MCHR1 (0.56) LMNAMAPTPOLBCXCR3DNMT3A
SCHEMBL11165965 0.85 MCHR1 (0.55) LMNAMAPTPOLBCXCR3MCHR1
SCHEMBL10356773 0.85 MCHR1 (0.55) LMNAMAPTPOLBCXCR3MCHR1
SCHEMBL11165531 0.85 MCHR1 (0.55) LMNAMAPTPOLBCXCR3MCHR1
SCHEMBL11178554 0.85 MAPT (0.52) LMNAMAPK1MAPTPOLBCXCR3
SCHEMBL11201219 0.83 MAPT (0.48) LMNAMAPTPOLBDNMT3AMCHR1

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
EP-0023569-B1 DERIVATIVES OF CARBOXYLIC ACIDS, THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM Dr. Karl Thomae GmbH (DE) 1983-06-22 — — EP disclosed
EP-0023569-A1 Derivatives of carboxylic acids, their preparation and medicaments containing them Dr. Karl Thomae GmbH (DE) 1981-02-11 — — EP disclosed
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