SCHEMBL9537162

SCHEMBL9537162

CCC(=O)N1Cc2cn[nH]c2-c2cc(OC)ccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.44
ADORA1 P30542 1/20 0.44
KMT2A Q03164 9/20 0.41
MEN1 O00255 8/20 0.41
MAPT P10636 5/20 0.41
ALOX12 P18054 4/20 0.41
TP53 P04637 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 3/20 0.41
NPSR1 Q6W5P4 3/20 0.41
USP2 O75604 3/20 0.41
HSD17B10 Q99714 2/20 0.41
HSP90AA1 P07900 1/20 0.41
XBP1 P17861 1/20 0.41
ALDH1A1 P00352 4/20 0.41
GAA P10253 3/20 0.40
TSHR P16473 2/20 0.40
HTT P42858 1/20 0.40
NOD2 Q9HC29 1/20 0.40
RECQL P46063 1/20 0.40

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
SCHEMBL9537585 0.88 KMT2A (0.39) ADORA3ADORA1KMT2AMEN1MAPT
SCHEMBL9536514 0.87 MAPT (0.40) ADORA3ADORA1KMT2AMEN1MAPT
SCHEMBL9538041 0.86 PSEN1 (0.44) ADORA3ADORA1KMT2AMEN1MAPT
SCHEMBL9536261 0.85 HSP90AA1 (0.45) ADORA3ADORA1KMT2AMEN1MAPT
SCHEMBL9538881 0.85 ADORA3 (0.44) ADORA3ADORA1KMT2AMEN1MAPT
SCHEMBL9538217 0.84 CYP11B1 (0.39) ADORA3ADORA1KMT2AMEN1MAPT
SCHEMBL9537742 0.84 PSEN1 (0.47) ADORA3KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL9538049 0.81 MAPT (0.42) KMT2AMEN1MAPTSMN1; SMN2LMNA
SCHEMBL9537326 0.81 PSEN1 (0.48) ADORA3ADORA1KMT2AMAPTSMN1; SMN2
SCHEMBL9537661 0.79 HSP90AA1 (0.39) ADORA3ADORA1MAPTSMN1; SMN2HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0180352-B1 BENZENE-FUSED HETEROCYCLIC COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-05-26 EP disclosed
US-4767780-A SUBSTITUTED 1,4-DIHYDRO-(1)-BENZOPYRANO(4,3-C)PYRAZOLES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-08-30 US disclosed
US-4675324-A Substituted pyrazolo [4,3-c]pyridines and their use as uricosuric, diuretic and anti-hypertensive agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-06-23 US disclosed
EP-0180352-A2 Benzene-fused heterocyclic compound FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-05-07 EP disclosed