SCHEMBL11807668

SCHEMBL11807668

COc1ccc(N)c(C(=O)O)c1.O=C1c2ccccc2C(=O)c2c1oc1ccc3ccccc3c21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 6/20 0.45
▸ EGFR P00533 1/20 0.43
▸ KDM4E B2RXH2 5/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ HPGD P15428 4/20 0.41
▸ CA12 O43570 2/20 0.41
▸ CA1 P00915 2/20 0.41
▸ CA2 P00918 2/20 0.41
▸ CA3 P07451 2/20 0.41
▸ CA5A P35218 2/20 0.41
▸ CA7 P43166 2/20 0.41
▸ CA9 Q16790 2/20 0.41
▸ CA14 Q9ULX7 2/20 0.41
▸ CA5B Q9Y2D0 2/20 0.41
▸ SLC16A3 O15427 1/20 0.41
▸ CA6 P23280 1/20 0.41
▸ LMNA P02545 3/20 0.40
▸ TSHR P16473 2/20 0.40
▸ AHR P35869 1/20 0.40
▸ HSD17B10 Q99714 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
SCHEMBL7570047 0.81 TERT (0.47) ABCG2EGFRKDM4EALDH1A1HPGD
SCHEMBL7571063 0.80 TERT (0.49) ABCG2EGFRKDM4EALDH1A1HPGD
SCHEMBL7575236 0.77 NTRK1 (0.55) ABCG2EGFRAHRMAPTMEN1
SCHEMBL29380973 0.70 SMN1; SMN2 (0.59) KDM4EALDH1A1MAPTSMN1; SMN2GLA
SCHEMBL221141 0.70 SMN1; SMN2 (0.59) KDM4EALDH1A1MAPTSMN1; SMN2GLA
SCHEMBL27720018 0.70 SMN1; SMN2 (0.59) KDM4EALDH1A1MAPTSMN1; SMN2GLA
SCHEMBL22247643 0.69 ABCG2 (0.54) ABCG2KDM4EALDH1A1HPGDAHR
SCHEMBL7574891 0.68 NTRK1 (0.44) ABCG2EGFRKDM4EALDH1A1HPGD
SCHEMBL9101234 0.67 GRK6 (0.46) EGFRKDM4EALDH1A1HPGDLMNA
SCHEMBL7569904 0.66 NTRK1 (0.44) KDM4EALDH1A1CA12CA1CA2

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-3954465-A Electrophoretic imaging members XEROX CORPORATION (US) 1976-05-04 — — US disclosed
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