SCHEMBL31233014

SCHEMBL31233014

O=CC=Cc1ccccc1C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 2/20 0.57
CCND1 P24385 2/20 0.57
ALDH1A1 P00352 4/20 0.50
ALOX15 P16050 1/20 0.50
TRPA1 O75762 3/20 0.48
LMNA P02545 2/20 0.48
ALOX5 P09917 1/20 0.48
MAPK1 P28482 1/20 0.48
CCNB2 O95067 1/20 0.46
CDK1 P06493 1/20 0.46
CCNB1 P14635 1/20 0.46
CCNB3 Q8WWL7 1/20 0.46
GRIK1 P39086 1/20 0.45
GRIA1 P42261 1/20 0.45
GRIA2 P42262 1/20 0.45
GRIA3 P42263 1/20 0.45
GRIA4 P48058 1/20 0.45
GRIK2 Q13002 1/20 0.45
GRIK3 Q13003 1/20 0.45
CYP1A2 P05177 1/20 0.44

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
SCHEMBL10473616 1.00 CDK4 (0.57) CDK4CCND1ALDH1A1ALOX15TRPA1
SCHEMBL4261638 1.00 CDK4 (0.57) CDK4CCND1ALDH1A1ALOX15TRPA1
SCHEMBL8902281 0.85 ALDH1A1 (0.62) ALDH1A1ALOX15TRPA1LMNAGRIK1
SCHEMBL70202 0.85 ALDH1A1 (0.62) ALDH1A1ALOX15TRPA1LMNAGRIK1
SCHEMBL70201 0.85 ALDH1A1 (0.62) ALDH1A1ALOX15TRPA1LMNAGRIK1
SCHEMBL11235202 0.82 ALDH1A1 (0.48) CDK4CCND1ALDH1A1ALOX15TRPA1
Hydrochloric Acid SCHEMBL2726871 0.81 MAOB (0.52) ALDH1A1ALOX15TRPA1LMNAALOX5
SCHEMBL29556927 0.79 ALDH1A1 (0.59) ALDH1A1ALOX15LMNACYP1A2CYP2C9
Benzene SCHEMBL28103329 0.79 ALDH1A1 (0.59) ALDH1A1ALOX15LMNACYP1A2CYP2C9
SCHEMBL20448823 0.79 ALDH1A1 (0.59) ALDH1A1ALOX15LMNACYP1A2CYP2C9

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
WO-2024233598-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS YewSavin, Inc. (US) 2024-11-14 WO disclosed