SCHEMBL13652824

SCHEMBL13652824

Cc1cc(-n2n3c4ccc(Cl)cc4n23)c(O)c(C(C)(C)c2ccccc2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 4/20 0.36
▸ CNR2 P34972 4/20 0.36
▸ ACSS2 Q9NR19 1/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ ACLY P53396 3/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ ESR1 P03372 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ ESR2 Q92731 1/20 0.32
▸ SMN1; SMN2 Q16637 3/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ CA2 P00918 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ TYR P14679 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30

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
SCHEMBL13652813 0.89 ESR1 (0.38) CNR1CNR2NPC1RAB9AALDH1A1
SCHEMBL13652836 0.88 CNR1 (0.36) CNR1CNR2ACSS2ACLYALDH1A1
SCHEMBL9002863 0.85 SMN1; SMN2 (0.46) NPC1RAB9AACLYALDH1A1SMN1; SMN2
SCHEMBL13652835 0.84 ACSS2 (0.35) CNR1CNR2ACSS2ACLYALDH1A1
SCHEMBL13652825 0.83 SMN1; SMN2 (0.35) CNR1CNR2ACSS2ACLYALDH1A1
SCHEMBL12774783 0.78 ALOX5 (0.37) NPC1RAB9AACLYALDH1A1CYP3A4
SCHEMBL2612593 0.77 ESR1 (0.42) CNR1CNR2ALDH1A1ESR1CYP3A4
SCHEMBL13652814 0.76 CYP3A4 (0.39) CNR1CNR2ALDH1A1ESR1CYP3A4
SCHEMBL13245893 0.75 SMN1; SMN2 (0.53) NPC1RAB9AALDH1A1SMN1; SMN2CA2
SCHEMBL9002272 0.75 CYP2C9 (0.35) ACLYALDH1A1CYP3A4SMN1; SMN2CA2

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-20090246416-A1 OPTICAL FILM, METHOD OF MANUFACTURING THE SAME, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY DEVICE KONICA MINOLTA OPTO, INC. (JP) 2009-10-01 — — US disclosed
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