SCHEMBL6966609

SCHEMBL6966609

CSc1ccc(-c2cc(N)n[nH]2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.66
ALDH1A1 P00352 2/20 0.61
KMT2A Q03164 2/20 0.61
MKNK1 Q9BUB5 1/20 0.61
MKNK2 Q9HBH9 1/20 0.61
MEN1 O00255 1/20 0.61
USP2 O75604 1/20 0.61
MITF O75030 1/20 0.60
TP53 P04637 1/20 0.60
DYRK1A Q13627 1/20 0.60
NPC1 O15118 2/20 0.57
MAPT P10636 2/20 0.57
RAB9A P51151 2/20 0.57
GFER P55789 1/20 0.57
LTA4H P09960 1/20 0.51
AXL P30530 1/20 0.49
KEAP1 Q14145 1/20 0.49
TRPM8 Q7Z2W7 1/20 0.49
HSD17B10 Q99714 2/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL21346561 0.80 AXL (0.50) SMN1; SMN2ALDH1A1KMT2AMKNK1MKNK2
SCHEMBL1662946 0.79 SMN1; SMN2 (1.00) SMN1; SMN2ALDH1A1KMT2AMKNK1MKNK2
SCHEMBL28573902 0.79 ALDH1A1 (0.71) SMN1; SMN2ALDH1A1KMT2AMKNK1MKNK2
SCHEMBL21346071 0.76 AXL (0.46) SMN1; SMN2ALDH1A1KMT2AMKNK1MKNK2
SCHEMBL22820481 0.76 AXL (0.46) SMN1; SMN2ALDH1A1KMT2AMKNK1MKNK2
SCHEMBL5630086 0.76 MKNK1 (1.00) SMN1; SMN2ALDH1A1KMT2AMKNK1MKNK2
SCHEMBL6956022 0.76 ALDH1A1 (0.67) SMN1; SMN2ALDH1A1KMT2AMKNK1MKNK2
SCHEMBL2303414 0.76 ALDH1A1 (0.67) SMN1; SMN2ALDH1A1KMT2AMKNK1MKNK2
SCHEMBL1702207 0.76 ALDH1A1 (0.67) SMN1; SMN2ALDH1A1KMT2AMKNK1MKNK2
SCHEMBL13815700 0.76 KMT2A (1.00) SMN1; SMN2ALDH1A1KMT2AMKNK1MKNK2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0955293-B1 UREA DERIVATIVES BANYU PHARMA CO LTD (JP) 2003-03-19 EP disclosed
EP-0945438-B1 PYRAZOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2003-03-05 EP disclosed
US-6057335-A Pyrazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-05-02 US disclosed
US-6043246-A Urea derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-03-28 US disclosed
EP-0955293-A1 NOVEL UREA DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-11-10 EP disclosed
EP-0945438-A1 PYRAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-09-29 EP disclosed