SCHEMBL11201219

SCHEMBL11201219

O=C(O)c1ccc(CCNC(=O)c2cc(Cl)ccc2N2CCSCC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.48
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ TP53 P04637 1/20 0.48
▸ LMNA P02545 3/20 0.47
▸ RAB9A P51151 4/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ MCHR1 Q99705 4/20 0.46
▸ CYP2D6 P10635 2/20 0.44
▸ CHRM1 P11229 1/20 0.44
▸ HTR2A P28223 1/20 0.44
▸ DNMT3A Q9Y6K1 1/20 0.44
▸ NPC1 O15118 3/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ GFER P55789 1/20 0.44
▸ POLB P06746 1/20 0.43
▸ CNR1 P21554 1/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 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
SCHEMBL11441498 0.90 MCHR1 (0.56) MAPTSMN1; SMN2LMNARAB9AMCHR1
SCHEMBL11165965 0.89 MCHR1 (0.55) MAPTLMNAHSD17B10MCHR1CYP2D6
SCHEMBL11165531 0.89 MCHR1 (0.55) MAPTLMNAHSD17B10MCHR1CYP2D6
SCHEMBL10356773 0.89 MCHR1 (0.55) MAPTLMNAHSD17B10MCHR1CYP2D6
SCHEMBL11194495 0.88 EGFR (0.53) MAPTSMN1; SMN2LMNARAB9AMCHR1
SCHEMBL11197083 0.87 MAPT (0.52) MAPTSMN1; SMN2TP53LMNARAB9A
SCHEMBL11193056 0.87 MAPT (0.46) MAPTSMN1; SMN2TP53LMNARAB9A
SCHEMBL11182439 0.86 LMNA (0.48) MAPTSMN1; SMN2TP53LMNARAB9A
SCHEMBL11191065 0.86 MAPT (0.54) MAPTSMN1; SMN2TP53LMNARAB9A
SCHEMBL11305498 0.83 MAPT (0.53) MAPTSMN1; SMN2TP53LMNARAB9A

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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