SCHEMBL7654038

SCHEMBL7654038

CSc1ccc(NC(=O)N(S)c2ccc(NC(=O)c3cc(F)ccc3F)cc2)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
PNLIP P16233 3/20 0.41
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 1/20 0.39
NPY1R P25929 1/20 0.39
NPY2R P49146 1/20 0.39
FADS1 O60427 2/20 0.39
AVPR2 P30518 1/20 0.39
OXTR P30559 1/20 0.39
AVPR1A P37288 1/20 0.39
P2RX1 P51575 1/20 0.38
LMNA P02545 2/20 0.37
TP53 P04637 1/20 0.37
NFKB1 P19838 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
SCHEMBL6814913 0.89 NPC1 (0.52) MAPTKMT2AMEN1PNLIPNPC1
SCHEMBL6819706 0.84 RAB9A (0.44) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL7654030 0.83 MEN1 (0.49) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL6814307 0.82 DHODH (0.50) MAPTKMT2AMEN1PNLIPNPC1
SCHEMBL6815742 0.81 APEX1 (0.42) MAPTKMT2AMEN1SMN1; SMN2LMNA
SCHEMBL6815060 0.79 NPC1 (0.52) MAPTKMT2AMEN1PNLIPNPC1
SCHEMBL6814389 0.79 NPC1 (0.53) MAPTKMT2AMEN1PNLIPNPC1
SCHEMBL6811612 0.79 GRM4 (0.46) MAPTKMT2AMEN1PNLIPNPC1
SCHEMBL6815406 0.78 FADS1 (0.58) MAPTKMT2AMEN1PNLIPNPC1
SCHEMBL7948376 0.77 AVPR2 (0.39) MAPTKMT2ANPC1RAB9ACTDSP1

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
US-6407249-B1 COMPOUNDS CONTAINING FURAN RING STRUCTURE AMERICAN HOME PRODUCTS CORPORATION 2002-06-18 US disclosed