SCHEMBL9496969

SCHEMBL9496969

NCc1cccnc1Nc1ccc(Cl)c(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.59
GRM4 Q14833 6/20 0.52
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
MAPT P10636 2/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KDR P35968 2/20 0.44
PDGFRB P09619 1/20 0.44
KIT P10721 1/20 0.44
FLT1 P17948 1/20 0.44
DPP4 P27487 1/20 0.43
STK17A Q9UEE5 2/20 0.42
STK17B O94768 1/20 0.42
BRAF P15056 1/20 0.41
NPC1 O15118 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
NPY5R Q15761 1/20 0.40
POLA1 P09884 1/20 0.39

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
SCHEMBL5248909 0.82 NPC1 (0.59) GRM4RAB9ANPC1HPGDHTT
SCHEMBL9839204 0.79 NPSR1 (0.52) NPSR1GRM4MEN1KMT2AMAPT
SCHEMBL5252795 0.78 DHODH (0.51) NPSR1GRM4MEN1KMT2AMAPT
SCHEMBL11731664 0.77 EGFR (0.46) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL11732793 0.77 GRM4 (0.52) NPSR1GRM4KMT2AMAPTRAB9A
SCHEMBL9497949 0.77 LMNA (0.59) GRM4RAB9ABRAFHTT
SCHEMBL9494044 0.74 RAB9A (0.64) NPSR1GRM4MEN1KMT2AMAPT
SCHEMBL9494146 0.73 ABCG2 (0.51) GRM4MEN1KMT2AMAPTRAB9A
SCHEMBL25341628 0.73 NPSR1 (0.54) NPSR1GRM4MEN1KMT2AMAPT
SCHEMBL7765065 0.72 HDAC3 (0.55) NPSR1GRM4MEN1KMT2AMAPT

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-5264437-A Antiinflammatory agents, immunosuppressants or antiallergens SYNTEX (U.S.A.) INC. (US) 1993-11-23 US disclosed