SCHEMBL1828255

SCHEMBL1828255

NC(=O)Oc1[nH]c2ccc(CNc3cccc(C(F)(F)F)c3)cc2c1Sc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 3/20 0.41
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
MAPT P10636 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
PDGFRB P09619 2/20 0.38
KDR P35968 2/20 0.38
LMNA P02545 3/20 0.38
PPARA Q07869 1/20 0.37
KMT2A Q03164 2/20 0.37
AURKA O14965 2/20 0.37
RPS6KB1 P23443 2/20 0.37
ABL1 P00519 1/20 0.37
EGFR P00533 1/20 0.37
CSF1R P07333 1/20 0.37
KIT P10721 1/20 0.37
FLT1 P17948 1/20 0.37
FLT4 P35916 1/20 0.37
AURKB Q96GD4 1/20 0.37
NTRK1 P04629 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
SCHEMBL1615151 0.87 RXFP1 (0.43) RXFP1FFAR1FFAR4MAPTSMN1; SMN2
SCHEMBL1823520 0.85 TUBB4A (0.48) RXFP1MAPTTP53
SCHEMBL1825063 0.81 TUBB4A (0.43) MAPTSMN1; SMN2KMT2AEGFRMEN1
SCHEMBL1823740 0.81 TUBB4A (0.38) MAPTLMNAKMT2AAURKARPS6KB1
SCHEMBL1824781 0.80 TUBB4A (0.44) MAPTSMN1; SMN2LMNAKMT2AMEN1
SCHEMBL1826034 0.80 FFAR1 (0.38) FFAR1FFAR4MAPTKMT2AMEN1
SCHEMBL1823610 0.79 TP53 (0.40) RXFP1MAPTPPARAKMT2AAURKA
SCHEMBL1827112 0.79 HDAC6 (0.46) KDRFLT1ALDH1A1
SCHEMBL1825597 0.78 TUBB4A (0.42) MAPTSMN1; SMN2LMNAKMT2AALDH1A1
SCHEMBL1827155 0.78 TUBB4A (0.42) RXFP1MAPTSMN1; SMN2KMT2AALDH1A1

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