SCHEMBL8733535

SCHEMBL8733535

Cc1ccc2c(c1)ncn2S.[Zn]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.53
GABRP O00591 1/20 0.42
GABRD O14764 1/20 0.42
GABRA1 P14867 1/20 0.42
GABRB1 P18505 1/20 0.42
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA5 P31644 1/20 0.42
GABRA3 P34903 1/20 0.42
GABRA2 P47869 1/20 0.42
GABRB2 P47870 1/20 0.42
GABRA4 P48169 1/20 0.42
GABRE P78334 1/20 0.42
GABRA6 Q16445 1/20 0.42
GABRG1 Q8N1C3 1/20 0.42
GABRG3 Q99928 1/20 0.42
GABRQ Q9UN88 1/20 0.42
CYP1A2 P05177 1/20 0.39
NPC1 O15118 6/20 0.38
RAB9A P51151 6/20 0.38

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
SCHEMBL1975997 0.98 FGFR1 (0.54) FGFR1GABRPGABRDGABRA1GABRB1
SCHEMBL434799 0.76 NPC1 (0.58) FGFR1GABRPGABRDGABRA1GABRB1
SCHEMBL20698180 0.74 FGFR1 (0.54) FGFR1GABRPGABRDGABRA1GABRB1
SCHEMBL21900387 0.74 FGFR1 (0.54) FGFR1GABRPGABRDGABRA1GABRB1
SCHEMBL4967369 0.74 FGFR1 (0.54) FGFR1NPC1RAB9ASMN1; SMN2TP53
SCHEMBL15241833 0.74 FGFR1 (0.54) FGFR1GABRPGABRDGABRA1GABRB1
SCHEMBL4580483 0.74 FGFR1 (0.58) FGFR1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL19911321 0.73 FGFR1 (0.53) FGFR1GABRPGABRDGABRA1GABRB1
SCHEMBL11055266 0.73 FGFR1 (0.53) FGFR1GABRPGABRDGABRA1GABRB1
SCHEMBL19911318 0.72 NPC1 (0.61) FGFR1GABRPGABRDGABRA1GABRB1

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-5804668-A PREPARED FROM AMIDINES, ZINC MERCAPTO COMPOUNDS, ELASTOMERS; IMPROVED STORAGE STABILITY, AGING RESISTANCE BAYER AG (DE) 1998-09-08 US disclosed