SCHEMBL20024723

SCHEMBL20024723

Oc1ccc2cc(Oc3ccc(/C=C/c4ccc(Oc5ccc6cc(O)ccc6c5)cc4)cc3)ccc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.52
▸ KMT2A Q03164 4/20 0.52
▸ KDM4E B2RXH2 4/20 0.52
▸ PTGS1 P23219 4/20 0.52
▸ CYP1A1 P04798 4/20 0.52
▸ PTGS2 P35354 4/20 0.52
▸ CYP1B1 Q16678 4/20 0.52
▸ LMNA P02545 3/20 0.52
▸ MAPT P10636 3/20 0.52
▸ CYP1A2 P05177 3/20 0.52
▸ TTR P02766 3/20 0.52
▸ ALOX5 P09917 3/20 0.52
▸ NQO2 P16083 3/20 0.52
▸ CA12 O43570 2/20 0.52
▸ CA1 P00915 2/20 0.52
▸ CA2 P00918 2/20 0.52
▸ CA3 P07451 2/20 0.52
▸ CA4 P22748 2/20 0.52
▸ CA6 P23280 2/20 0.52
▸ CA5A P35218 2/20 0.52

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
SCHEMBL23386082 0.89 ESR1 (0.62) MEN1KMT2ACYP1A2CYP3A4CYP2C9
SCHEMBL23386311 0.87 ESR1 (0.67) MEN1KMT2ACYP1A2CYP3A4HIF1A
SCHEMBL10014247 0.87 ESR1 (0.57) MEN1KMT2ACYP1A2CYP3A4CYP2C9
SCHEMBL10331753 0.84 ALDH5A1 (0.48) MEN1KMT2AKDM4EPTGS1LMNA
SCHEMBL23386131 0.83 ESR1 (0.61) MEN1KMT2ACYP1A2CYP3A4CYP2C9
SCHEMBL12054411 0.83 CYP1A2 (0.58) MEN1KMT2AMAPTCYP1A2CYP3A4
SCHEMBL20356051 0.83 CYP1A2 (0.58) MEN1KMT2AMAPTCYP1A2CYP3A4
SCHEMBL12054413 0.83 CYP1A2 (0.58) MEN1KMT2AMAPTCYP1A2CYP3A4
SCHEMBL9619578 0.83 ESR1 (0.74) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL20024731 0.82 LCK (0.55) MEN1KMT2AKDM4EPTGS1CYP1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10655029-B2 Inkjet ink and coloring composition RICOH COMPANY, LTD. (JP) 2020-05-19 — — US disclosed
US-20180094155-A1 INKJET INK AND COLORING COMPOSITION RICOH COMPANY, LTD. (JP) 2018-04-05 — — US disclosed
US-20180094155-A1 INKJET INK AND COLORING COMPOSITION RICOH COMPANY, LTD. (JP) 2018-04-05 — — US disclosed
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