SCHEMBL7281012

SCHEMBL7281012

N=C(N)c1ccc(-n2ccn(-c3ccc(C=CC(=O)O)cc3)c2=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.47
PRMT1 Q99873 1/20 0.47
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
CYP2C19 P33261 1/20 0.47
HSD17B10 Q99714 1/20 0.47
ESR1 P03372 3/20 0.41
HCAR2 Q8TDS4 2/20 0.41
ESR2 Q92731 2/20 0.41
CA12 O43570 1/20 0.41
AKR1B10 O60218 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA3 P07451 1/20 0.41
PKM P14618 1/20 0.41
TYR P14679 1/20 0.41
AKR1B1 P15121 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
DPP4 P27487 1/20 0.41

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
SCHEMBL7281005 1.00 PRMT5 (0.47) PRMT5PRMT1ALDH1A1HPGDCYP2C19
Hydrochloric Acid SCHEMBL8911072 0.84 CA12 (0.46) PRMT5PRMT1ALDH1A1HPGDCYP2C19
Hydrochloric Acid SCHEMBL7283420 0.84 CA12 (0.46) PRMT5PRMT1ALDH1A1HPGDCYP2C19
SCHEMBL7275693 0.80 PRMT1 (0.54) PRMT5PRMT1ALDH1A1HPGDCYP2C19
SCHEMBL7275685 0.80 PRMT1 (0.54) PRMT5PRMT1ALDH1A1HPGDCYP2C19
SCHEMBL8863502 0.79 PRMT1 (0.42) PRMT5PRMT1ALDH1A1HPGDCYP2C19
SCHEMBL9093297 0.79 PRMT1 (0.42) PRMT5PRMT1ALDH1A1HPGDCYP2C19
SCHEMBL8863342 0.77 PRMT5 (0.46) PRMT5PRMT1ALDH1A1HPGDCYP2C19
SCHEMBL7276107 0.73 ITGB3 (0.67) ITGB3ITGA2BF10F2
SCHEMBL7403166 0.72 ITGB3 (0.45) ITGB3ITGA2BF2

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
US-5852192-A Cyclic urea derivatives, pharmaceutical compositions containing these compounds and processes for preparing them DR. KARL THOMAE GMBH (DE) 1998-12-22 US disclosed
US-5650424-A ANTIAGGLOMERANTS USING IMIDAZOLIDINDIONES DR. KARL THOMAE GMBH (DE) 1997-07-22 US disclosed
EP-0503548-B1 Cyclic urea derivatives, medicaments contaning them and process for their preparation THOMAE GMBH DR K (DE) 1997-06-04 EP disclosed
US-5478942-A Antiinflammatory agents, antiagglomerants KARL THOMAE GMBH (DE) 1995-12-26 US disclosed
US-5276049-A Treatment of thrombosis DR. KARL THOMAE GMBH (DE) 1994-01-04 US disclosed
EP-0503548-A1 Cyclic urea derivatives, medicaments contaning them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-09-16 EP disclosed