SCHEMBL7230679

SCHEMBL7230679

Cc1ccnc(Oc2cccc(N=C(NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.37
NPFFR1 Q9GZQ6 1/20 0.37
NPFFR2 Q9Y5X5 1/20 0.37
AAK1 Q2M2I8 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
DRD1 P21728 1/20 0.35
LOXL2 Q9Y4K0 7/20 0.34
GPR119 Q8TDV5 1/20 0.34
LOX P28300 6/20 0.34
MAPK8 P45983 1/20 0.33
MAPK10 P53779 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL7844181 0.83 KDR (0.40) ALDH1A1MAPTLOXL2GPR119LOX
SCHEMBL7229865 0.82 CNR1 (0.43) NPFFR1NPFFR2AAK1
SCHEMBL7842034 0.80 PPARG (0.36) PPARGALDH1A1MAPTDRD1LOXL2
SCHEMBL17560318 0.78 HTR3E (0.50) NPFFR1NPFFR2MAPTRAB9A
SCHEMBL7842037 0.76 F2 (0.37) PPARGAAK1LOXL2LOXMAPK8
Hydrochloric Acid SCHEMBL7231281 0.75 TAAR1 (0.55) PPARGALDH1A1MAPTLOXL2LOX
SCHEMBL7229573 0.74 CCR1 (0.40) NPFFR1NPFFR2AAK1ALDH1A1MAPT
SCHEMBL7240889 0.73 TRPV1 (0.39) NPFFR1NPFFR2RAB9A
SCHEMBL7230300 0.72 ACACB (0.40) NPFFR1NPFFR2AAK1MAPTMAPK8
SCHEMBL17560548 0.72 NOS1 (0.47) NPFFR1NPFFR2ALDH1A1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6521643-B1 Prevention and/or treatment of nitric oxide synthasey medi-ated diseases such as adult respiratory distress syndrome, myocarditis, synovitis, septic shock, diabetes, ulcerative colitis, cerebral infarction, osteoarthritis FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-02-18 US disclosed
EP-1157022-A1 PYRIDINE COMPOUNDS AND THEIR PHARMACEUTICAL USE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-11-28 EP disclosed
WO-2000049015-A1 PYRIDINE COMPOUNDS AND THEIR PHARMACEUTICAL USE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-08-24 WO disclosed