SCHEMBL7977622

SCHEMBL7977622

O=C(O)c1nc(-c2ccc(OCc3ccccc3)cc2)[nH]c1-c1ccc(F)cc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 6/20 0.58
PRMT5 O14744 7/20 0.53
CHEK2 O96017 1/20 0.53
MMP1 P03956 1/20 0.52
MMP2 P08253 1/20 0.52
MMP9 P14780 1/20 0.52
MMP13 P45452 1/20 0.52
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
NR4A2 P43354 1/20 0.49

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
SCHEMBL7989975 0.89 DHODH (0.61) DHODHPRMT5CHEK2MEN1KMT2A
SCHEMBL7977709 0.89 DHODH (0.58) DHODHPRMT5CHEK2MEN1KMT2A
SCHEMBL7991836 0.89 DHODH (0.58) DHODHPRMT5CHEK2MEN1KMT2A
SCHEMBL7977899 0.87 PRMT5 (0.56) DHODHPRMT5CHEK2MMP13MEN1
SCHEMBL7988792 0.82 MEN1 (0.52) DHODHPRMT5MEN1KMT2A
SCHEMBL7989696 0.82 ALOX5 (0.47) DHODHCHEK2MEN1KMT2A
SCHEMBL2648771 0.79 MAPK13 (0.72) PRMT5
SCHEMBL9193657 0.79 MAPK13 (0.72) PRMT5
SCHEMBL7988588 0.78 PRMT5 (0.58) DHODHPRMT5CHEK2MEN1KMT2A
SCHEMBL7977737 0.78 PRMT5 (0.57) DHODHPRMT5CHEK2MEN1KMT2A

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-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed