SCHEMBL1823959

SCHEMBL1823959

NC(=O)Oc1[nH]c2cc(CNCc3ccc(Cl)cc3)ccc2c1Sc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.48
MAPT P10636 3/20 0.48
POLB P06746 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP3A4 P08684 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
ALOX12 P18054 1/20 0.39
PPARG P37231 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ENPP2 Q13822 1/20 0.39
ALDH1A1 P00352 1/20 0.38
RHEB Q15382 1/20 0.37
TUBB4A P04350 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
TUBA1B P68363 1/20 0.37

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
SCHEMBL1826130 0.94 TP53 (0.44) TP53MAPTPOLBMEN1KMT2A
SCHEMBL1826315 0.91 TP53 (0.42) TP53MAPTPOLBMEN1KMT2A
SCHEMBL1822442 0.91 TP53 (0.42) TP53MAPTPOLBMEN1KMT2A
SCHEMBL1824783 0.90 MAPT (0.44) TP53MAPTPOLBMEN1KMT2A
SCHEMBL1822579 0.89 TP53 (0.41) TP53MAPTPOLBMEN1KMT2A
SCHEMBL1826145 0.89 TP53 (0.40) TP53MAPTPOLBMEN1KMT2A
SCHEMBL1827585 0.88 TP53 (0.53) TP53MAPTPOLBMEN1KMT2A
SCHEMBL1824690 0.87 TP53 (0.42) TP53MAPTPOLBMEN1KMT2A
SCHEMBL1823610 0.87 TP53 (0.40) TP53MAPTPOLBMEN1KMT2A
SCHEMBL1821161 0.87 TP53 (0.40) TP53MAPTPOLBMEN1KMT2A

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
EP-1794122-B1 3-SUBSTITUTED-5- AND 6-AMINOALKYL INDOLE-2-CARBOXYLIC ACID AMIDES AND RELATED ANALOGS AS INHIBITORS OF CASEIN KINASE I AVENTIS PHARMA INC (US) 2011-05-04 EP claimed