SCHEMBL9272736

SCHEMBL9272736

CSc1sc2ccccc2c1CC#N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.43
SRC P12931 1/20 0.43
GPR3 P46089 1/20 0.36
ALDH1A1 P00352 3/20 0.33
LMNA P02545 1/20 0.33
NR2F2 P24468 1/20 0.33
HTT P42858 1/20 0.33
TSHR P16473 3/20 0.32
CYP1A2 P05177 2/20 0.32
HSD17B10 Q99714 2/20 0.32
CYP2D6 P10635 1/20 0.32
NFKB1 P19838 1/20 0.32
FTO Q9C0B1 1/20 0.32
RAB9A P51151 3/20 0.32
USP2 O75604 1/20 0.32
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
ALOX12 P18054 1/20 0.32
GRIA4 P48058 1/20 0.31
LOXL2 Q9Y4K0 1/20 0.31

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
SCHEMBL9270189 0.80 CYP1A2 (0.48) EGFRSRCGPR3ALDH1A1LMNA
SCHEMBL8339082 0.75 LOXL2 (0.41) EGFRSRCGPR3ALDH1A1LMNA
SCHEMBL9262595 0.73 KDM4E (0.45) EGFRALDH1A1LMNATSHRCYP1A2
SCHEMBL11532670 0.72 L3MBTL1 (0.39) EGFRSRCGPR3ALDH1A1LMNA
SCHEMBL9016796 0.70 GRIA4 (0.45) GPR3ALDH1A1LMNACYP1A2HSD17B10
SCHEMBL9266269 0.70 GPR3 (0.46) GPR3ALDH1A1RAB9APOLBMEN1
SCHEMBL10372811 0.68 GPR3 (0.44) GPR3ALDH1A1LMNAHTTTSHR
SCHEMBL11311400 0.68 EGFR (0.52) EGFRSRCALDH1A1LMNAHTT
SCHEMBL10735490 0.66 EGFR (0.50) EGFRSRCALDH1A1LMNAHTT
SCHEMBL17072313 0.65 LOXL2 (0.41) EGFRSRCGPR3ALDH1A1LMNA

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-5468874-A Optical color filters, masking and display materials; high contrast, stable color developing or extinction MITA INDUSTRIAL CO., LTD. (JP) 1995-11-21 US disclosed