SCHEMBL14392207

SCHEMBL14392207

O=Cc1ccc(-c2cncc3ccccc23)cc1Nc1ccc(F)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ERN1 O75460 5/20 0.53
▸ CYP11B1 P15538 5/20 0.46
▸ CYP11B2 P19099 5/20 0.46
▸ PIK3CD O00329 1/20 0.45
▸ PIK3CA P42336 1/20 0.45
▸ PIK3CG P48736 1/20 0.45
▸ CYP17A1 P05093 1/20 0.42
▸ PRKCZ Q05513 1/20 0.41
▸ CYP2D6 P10635 2/20 0.41
▸ CYP2C9 P11712 2/20 0.41
▸ CYP2B6 P20813 2/20 0.41
▸ CYP2C19 P33261 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ EGFR P00533 1/20 0.41
▸ KDR P35968 1/20 0.41
▸ MMP9 P14780 2/20 0.41
▸ ADRA2A P08913 1/20 0.40
▸ ADRA2B P18089 1/20 0.40
▸ ADRA2C P18825 1/20 0.40

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
SCHEMBL4220149 0.81 XDH (0.48) ERN1CYP11B1CYP11B2CYP17A1KDR
SCHEMBL13825832 0.77 MMP2 (0.46) PRKCZCYP2D6CYP2C19CYP1A2CYP3A4
SCHEMBL13890892 0.76 MEN1 (0.42) PRKCZCYP2D6CYP2C19CYP1A2CYP3A4
SCHEMBL4212947 0.76 ABCG2 (0.44) ERN1CYP11B1CYP11B2PIK3CGCYP17A1
SCHEMBL12074902 0.75 PRKCZ (0.69) ERN1CYP11B1CYP11B2CYP17A1PRKCZ
SCHEMBL13890975 0.74 ERN1 (0.48) ERN1CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL13825820 0.73 MAPT (0.41) CYP11B1CYP11B2CYP17A1PRKCZCYP2D6
SCHEMBL13890941 0.72 ALOX5AP (0.41) ERN1PRKCZCYP2D6CYP2C9CYP2C19
SCHEMBL13890939 0.71 MAPK14 (0.54) PIK3CDPIK3CGMMP9
SCHEMBL13890911 0.71 MAPT (0.38) PRKCZCYP2D6CYP2C19CYP1A2CYP3A4

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
EP-1860098-A1 NOVEL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2007-11-28 — — EP disclosed
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