SCHEMBL7656098

SCHEMBL7656098

COC(=O)c1cc(Cc2cccc(CO)c2)cc(-c2cccc(C#N)c2)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.45
PLAU P00749 1/20 0.43
CYP4F2 P78329 3/20 0.41
CYP4A11 Q02928 3/20 0.41
DHFR P00374 2/20 0.40
LOXL2 Q9Y4K0 1/20 0.40
EGLN1 Q9GZT9 1/20 0.39
KAT6A Q92794 1/20 0.39
CTSL P07711 1/20 0.38
CHRM3 P20309 1/20 0.38
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
XDH P47989 1/20 0.37
SLC22A12 Q96S37 1/20 0.37
VNN1 O95497 1/20 0.37
SIRT5 Q9NXA8 1/20 0.37

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
SCHEMBL6751413 0.91 PLAU (0.47) MRGPRX4PLAUCYP4F2CYP4A11LOXL2
SCHEMBL7656101 0.86 PLAU (0.42) MRGPRX4PLAUCYP4F2CYP4A11LOXL2
SCHEMBL6749963 0.83 CYP4F2 (0.48) MRGPRX4PLAUCYP4F2CYP4A11LOXL2
SCHEMBL6753784 0.83 LOXL2 (0.53) MRGPRX4PLAUCYP4F2CYP4A11LOXL2
SCHEMBL7663246 0.81 MRGPRX4 (0.48) MRGPRX4PLAULOXL2KAT6AMEN1
SCHEMBL7717556 0.80 PLAU (0.50) MRGPRX4PLAUEGLN1KAT6AXDH
SCHEMBL7714047 0.79 MRGPRX4 (0.51) MRGPRX4PLAUEGLN1KAT6A
SCHEMBL7662548 0.79 MRGPRX4 (0.51) MRGPRX4PLAUKAT6AMEN1KMT2A
SCHEMBL7665912 0.79 MRGPRX4 (0.48) MRGPRX4PLAU
SCHEMBL7822720 0.78 PLAU (0.61) MRGPRX4PLAULOXL2KAT6AXDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6348478-B1 BLOOD COAGULATION FACTORS AND ANTICOAGULANTS TEIJIN LIMITED (JP) 2002-02-19 US disclosed
EP-1043311-A1 BIPHENYLAMIDINE DERIVATIVES TEIJIN LIMITED (JP) 2000-10-11 EP disclosed