SCHEMBL24960484

SCHEMBL24960484

C/C=C1/C(=O)c2cc(C)c(C)cc2C1=C(C#N)C#N

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.36
PKM P14618 2/20 0.36
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
EGFR P00533 4/20 0.33
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
NQO1 P15559 1/20 0.30
POR P16435 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL21173227 0.86 MAPT (0.36) MAPTPKMALDH1A1GAAEGFR
SCHEMBL25656474 0.86 MAPT (0.36) MAPTPKMALDH1A1GAAEGFR
SCHEMBL25612614 0.86 USP8 (0.40) MAPTPKMALDH1A1GAAEGFR
SCHEMBL25656471 0.86 LCK (0.36) MAPTPKMALDH1A1GAAEGFR
SCHEMBL25612604 0.86 MAPT (0.36) MAPTPKMALDH1A1GAAEGFR
SCHEMBL21173225 0.86 USP8 (0.40) MAPTPKMALDH1A1GAAEGFR
SCHEMBL21173224 0.86 LCK (0.36) MAPTPKMALDH1A1GAAEGFR
SCHEMBL25759331 0.83 PKM (0.34) MAPTPKMALDH1A1GAAEGFR
SCHEMBL25656477 0.83 EGFR (0.46) MAPTPKMALDH1A1GAAEGFR
SCHEMBL24960488 0.82 ALDH1A1 (0.33) MAPTPKMALDH1A1GAAEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023139992-A1 INK COMPOSITION AND PHOTOELECTRIC CONVERSION DEVICE USING SAID INK COMPOSITION 住友化学株式会社 2023-07-27 WO disclosed
WO-2023120359-A1 COMPOUND AND PHOTOELECTRIC CONVERSION ELEMENT USING SAME 住友化学株式会社 2023-06-29 WO disclosed
EP-4186909-A1 COMPOUND AND PHOTOELECTRIC CONVERSION ELEMENT USING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-05-31 EP disclosed
WO-2023008376-A1 COMPOUND, COMPOSITION, AND PHOTOELECTRIC CONVERSION ELEMENT 住友化学株式会社 2023-02-02 WO disclosed