SCHEMBL28569874

SCHEMBL28569874

C=Cc1cc(OC)c(O)c(C(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.50
MAPT P10636 3/20 0.44
KMT2A Q03164 3/20 0.44
GAA P10253 1/20 0.44
ABL1 P00519 1/20 0.42
BCR P11274 1/20 0.42
CYP3A4 P08684 4/20 0.41
CYP1A2 P05177 3/20 0.41
CYP2B6 P20813 3/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2D6 P10635 1/20 0.41
PKM P14618 1/20 0.40
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
TUBB1 Q9H4B7 1/20 0.39
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
LMNA P02545 2/20 0.38

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
SCHEMBL727024 0.83 TRPA1 (0.62) TRPA1MAPTKMT2AGAAABL1
SCHEMBL6443870 0.83 TRPA1 (0.62) TRPA1MAPTKMT2AGAAABL1
SCHEMBL5200323 0.83 CA1 (0.56) GAACYP3A4CYP1A2CYP2B6PTGS1
SCHEMBL2269883 0.83 ALDH1A1 (0.50) MAPTKMT2AGAAABL1BCR
SCHEMBL3703392 0.80 TRPA1 (0.63) TRPA1MAPTKMT2AGAAABL1
SCHEMBL18116476 0.77 EGFR (0.58) TRPA1MAPTKMT2AGAAABL1
SCHEMBL2902721 0.76 PKM (0.74) GAACYP3A4CYP1A2CYP2B6CYP2C9
SCHEMBL2897838 0.76 PKM (0.45) MAPTKMT2AGAAABL1CYP3A4
SCHEMBL2902719 0.76 PKM (0.74) GAACYP3A4CYP1A2CYP2B6CYP2C9
SCHEMBL4576166 0.76 TRPA1 (0.48) TRPA1MAPTKMT2AGAAABL1

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
CN-108255018-B Photoresist composition comprising poly (p-hydroxystyrene) epoxy resin as film-forming resin 湖北固润科技股份有限公司 2020-12-11 CN disclosed