SCHEMBL11194495

SCHEMBL11194495

O=C(O)c1ccc(CCNC(=O)c2cc(Cl)ccc2N2CCOCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.53
▸ CDK2 P24941 1/20 0.53
▸ RXFP1 Q9HBX9 1/20 0.50
▸ MAPT P10636 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ BACE1 P56817 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.46
▸ MCHR1 Q99705 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ HTR1A P08908 1/20 0.46
▸ MAOA P21397 1/20 0.46

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) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL10356773 0.89 MCHR1 (0.55) MAPTLMNAPOLBMCHR1
SCHEMBL11165531 0.89 MCHR1 (0.55) MAPTLMNAPOLBMCHR1
SCHEMBL11165965 0.89 MCHR1 (0.55) MAPTLMNAPOLBMCHR1
SCHEMBL11197083 0.89 MAPT (0.52) EGFRCDK2MAPTLMNANPC1
SCHEMBL11201219 0.88 MAPT (0.48) MAPTMEN1KMT2ALMNANPC1
SCHEMBL11157981 0.87 ALDH1A1 (0.49) EGFRCDK2MAPTMEN1KMT2A
SCHEMBL11193056 0.87 MAPT (0.46) MAPTMEN1KMT2ALMNANPC1
SCHEMBL11191065 0.86 MAPT (0.54) MAPTKMT2ALMNANPC1RAB9A
SCHEMBL11182439 0.86 LMNA (0.48) MAPTLMNANPC1RAB9AMAPK1

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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