SCHEMBL24564952

SCHEMBL24564952

Bc1ccc2c3c(cccc13)-c1c-2c(C(C)C)c2ccccc2c1C(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PABPC1 P11940 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ KEAP1 Q14145 2/20 0.35
▸ NFE2L2 Q16236 2/20 0.35
▸ CRHBP P24387 1/20 0.35
▸ CRHR2 Q13324 1/20 0.35
▸ KMT2A Q03164 3/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ USP2 O75604 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ POLB P06746 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ HIF1A Q16665 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31

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
SCHEMBL9613694 0.75 KEAP1 (0.58) PABPC1KDM4EMAPTSMN1; SMN2KEAP1
SCHEMBL22355589 0.72 MAPT (0.40) PABPC1KDM4EMAPTSMN1; SMN2KEAP1
SCHEMBL14821367 0.72 LPL (0.32) PABPC1KDM4EMAPTSMN1; SMN2KEAP1
SCHEMBL18820577 0.71 DNMT1 (0.42) KDM4EMAPTSMN1; SMN2KEAP1NFE2L2
SCHEMBL12228498 0.71 ENPP1 (0.37) PABPC1KDM4EMAPTSMN1; SMN2KEAP1
SCHEMBL20835013 0.69 MAPT (0.66) PABPC1KDM4EMAPTSMN1; SMN2KEAP1
SCHEMBL22355558 0.69 CRHBP (0.35) PABPC1KDM4EMAPTSMN1; SMN2KEAP1
SCHEMBL12524019 0.69 KEAP1 (0.35) PABPC1KDM4EMAPTSMN1; SMN2KEAP1
SCHEMBL24564951 0.69 — —
SCHEMBL13090233 0.67 ALDH1A1 (0.50) PABPC1KDM4EMAPTSMN1; SMN2KEAP1

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-3696155-B1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CANON KK (JP) 2022-06-29 — — EP disclosed
Send feedback