SCHEMBL28830141

SCHEMBL28830141

CC(C=O)=Cc1ccccc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.56
TRIM33 Q9UPN9 1/20 0.56
ALDH1A1 P00352 1/20 0.55
TSHR P16473 1/20 0.55
MAPT P10636 2/20 0.50
LMNA P02545 1/20 0.50
CDK4 P11802 1/20 0.48
CCND1 P24385 1/20 0.48
ERN1 O75460 1/20 0.47
NFKB1 P19838 2/20 0.44
JUN P05412 1/20 0.44
NFE2L2 Q16236 1/20 0.44
CA2 P00918 5/20 0.42
CA1 P00915 2/20 0.42
CA4 P22748 1/20 0.42
TRPA1 O75762 1/20 0.41
RAB9A P51151 2/20 0.40
CA12 O43570 3/20 0.39
KDM4E B2RXH2 2/20 0.39
CA9 Q16790 2/20 0.39

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
SCHEMBL13589808 1.00 TRIM24 (0.56) TRIM24TRIM33ALDH1A1TSHRMAPT
SCHEMBL5030176 0.81 ALDH1A1 (0.57) TRIM24TRIM33ALDH1A1TSHRMAPT
SCHEMBL28280107 0.79 ALDH1A1 (0.56) TRIM24TRIM33ALDH1A1TSHRMAPT
SCHEMBL13589834 0.78 TRIM24 (0.60) TRIM24TRIM33ALDH1A1MAPTLMNA
SCHEMBL276965 0.78 TRIM24 (0.52) TRIM24TRIM33ALDH1A1MAPTLMNA
SCHEMBL31000832 0.78 TRIM24 (0.52) TRIM24TRIM33ALDH1A1MAPTLMNA
SCHEMBL11744877 0.78 ALDH1A1 (0.53) ALDH1A1TSHRMAPTLMNACA2
SCHEMBL5203307 0.78 ALDH1A1 (0.53) ALDH1A1TSHRMAPTERN1NFE2L2
SCHEMBL21294253 0.78 ALDH1A1 (0.53) TRIM24TRIM33ALDH1A1TSHRMAPT
SCHEMBL11744871 0.78 ALDH1A1 (0.53) ALDH1A1TSHRMAPTLMNACA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105611923-B Sodium channel modulators for the treatment of pain and diabetes 卓莫赛尔公司 2019-08-23 CN disclosed
CN-105611923-A Sodium channel modulators for the treatment of pain and diabetes CHROMOCELL CORP 2016-05-25 CN disclosed