SCHEMBL11141287

SCHEMBL11141287

Cc1ccc(C)c(NC(=O)N(Cc2ccccc2)Cc2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 3/20 0.56
▸ ALDH1A1 P00352 2/20 0.56
▸ MEN1 O00255 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ HTT P42858 1/20 0.54
▸ BRD4 O60885 1/20 0.53
▸ TRPV1 Q8NER1 1/20 0.51
▸ POLB P06746 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ LMNA P02545 2/20 0.49
▸ EGFR P00533 1/20 0.49
▸ ERBB2 P04626 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.47

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
SCHEMBL11140628 0.89 MEN1 (0.57) NPSR1ALDH1A1MEN1KMT2AMAPK1
SCHEMBL11143426 0.86 MAPK1 (0.60) NPSR1ALDH1A1MEN1KMT2AMAPK1
SCHEMBL30734411 0.85 ALDH1A1 (0.63) NPSR1ALDH1A1KMT2AMAPK1TRPV1
SCHEMBL11139406 0.85 ALDH1A1 (0.63) NPSR1ALDH1A1KMT2AMAPK1TRPV1
SCHEMBL11137902 0.84 KMT2A (0.61) NPSR1ALDH1A1MEN1KMT2AHTT
SCHEMBL10887336 0.82 MEN1 (0.52) NPSR1ALDH1A1MEN1KMT2AMAPK1
SCHEMBL10885852 0.82 MEN1 (0.54) NPSR1ALDH1A1MEN1KMT2AMAPK1
SCHEMBL10890123 0.80 KDM4E (0.53) NPSR1ALDH1A1MEN1KMT2AMAPK1
SCHEMBL9784527 0.80 MEN1 (0.49) NPSR1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL10889203 0.80 HTT (0.59) NPSR1ALDH1A1MEN1KMT2AHTT

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-4387106-A ANTICHOLESTEROL AGENTS, ANTILIPEMIC AGENTS AMERICAN CYANAMID COMPANY (US) 1983-06-07 — — US claimed
US-4387106-A ANTICHOLESTEROL AGENTS, ANTILIPEMIC AGENTS AMERICAN CYANAMID COMPANY (US) 1983-06-07 — — US disclosed
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