SCHEMBL8977372

SCHEMBL8977372

Fc1cc2nc(S)[nH]c2cc1-n1cccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 2/20 0.35
GRIA2 P42262 2/20 0.35
GRIA3 P42263 2/20 0.35
GRIA4 P48058 2/20 0.35
CYP11B2 P19099 1/20 0.33
CBFB Q13951 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B10 Q99714 1/20 0.33
OPRL1 P41146 2/20 0.32
CYP19A1 P11511 1/20 0.32
GRIK1 P39086 1/20 0.31
GRIK2 Q13002 1/20 0.31
GRIK3 Q13003 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
SCHEMBL8977368 0.94 OPRL1 (0.37) GRIA1GRIA2GRIA3GRIA4CYP11B2
SCHEMBL8977340 0.81 GRIA1 (0.35) GRIA1GRIA2GRIA3GRIA4CYP11B2
SCHEMBL213270 0.77 KDM4E (0.49) CYP11B2CBFBKDM4EALDH1A1CYP1A2
SCHEMBL8071082 0.77 CYP19A1 (0.36) GRIA1GRIA2GRIA3GRIA4CYP11B2
SCHEMBL8977332 0.75 OPRL1 (0.37) GRIA1GRIA2GRIA3GRIA4CYP11B2
SCHEMBL12963078 0.75 KDM4E (0.40) CYP11B2CBFBKDM4EALDH1A1CYP1A2
SCHEMBL16134561 0.74 KDM4E (0.38) CBFBKDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL8977366 0.72 CYP19A1 (0.35) CYP19A1
SCHEMBL8977358 0.72 CYP19A1 (0.32) GRIA1GRIA2GRIA3GRIA4CYP19A1
SCHEMBL211043 0.71 ALDH1A1 (0.44) GRIA1GRIA2GRIA3GRIA4CBFB

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-5554631-A ANTIULCER IL-YANG PHARM. CO., LTD. (KR) 1996-09-10 US disclosed