SCHEMBL6131129

SCHEMBL6131129

Nc1ccc(-c2ccc(N)c(O)c2)cc1O.O=C(O)c1ccc(-c2cccc(C(=O)O)c2C(=O)OC(=O)c2c(C(=O)O)cccc2-c2ccc(C(=O)O)c(C(=O)O)c2)cc1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.43
▸ GFER P55789 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ PPM1B O75688 1/20 0.43
▸ MCL1 Q07820 6/20 0.42
▸ CYP3A4 P08684 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ ACMSD Q8TDX5 6/20 0.40
▸ HNF4A P41235 2/20 0.40
▸ DHFR P00374 1/20 0.38
▸ XDH P47989 1/20 0.37
▸ SLC22A12 Q96S37 1/20 0.37
▸ G6PD P11413 1/20 0.36
▸ CASP7 P55210 1/20 0.36
▸ CASP6 P55212 1/20 0.36
▸ MMP2 P08253 1/20 0.36
▸ IKBKB O14920 1/20 0.36

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
SCHEMBL1346651 0.87 MCL1 (0.42) KDM4EGFERKMT2ARXFP1MCL1
SCHEMBL10413641 0.78 MCL1 (0.41) MCL1HSD17B10ACMSDHNF4ADHFR
SCHEMBL9240427 0.77 CDC25B (0.47) KDM4EGFERKMT2ARXFP1MCL1
SCHEMBL23270907 0.76 CYP3A4 (0.52) KDM4EGFERKMT2ARXFP1PPM1B
SCHEMBL87895 0.76 CDC25B (0.49) KDM4EGFERKMT2ARXFP1MCL1
SCHEMBL17267883 0.75 CYP3A4 (0.47) KDM4EGFERKMT2ARXFP1PPM1B
Water SCHEMBL9437059 0.74 CDC25B (0.47) KDM4EGFERKMT2ARXFP1MCL1
Pyromellitic Acid SCHEMBL15228126 0.74 CDC25B (0.47) KDM4EGFERKMT2ARXFP1MCL1
Water SCHEMBL6403598 0.74 CDC25B (0.47) KDM4EGFERKMT2ARXFP1MCL1
SCHEMBL28679459 0.74 CDC25B (0.47) KDM4EGFERKMT2ARXFP1MCL1

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-20050064325-A1 Planographic printing plate precursor FUJI PHOTO FILM CO., LTD. 2005-03-24 — — US disclosed
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