SCHEMBL2133996

SCHEMBL2133996

C=CC(C)=CC(=O)C=C(C)C

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
TSHR P16473 3/20 0.32
TP53 P04637 1/20 0.32
LMNA P02545 1/20 0.32
FGFR4 P22455 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
SCHEMBL2133992 1.00 ALDH1A1 (0.43) ALDH1A1TSHRTP53LMNAFGFR4
SCHEMBL29634817 1.00 ALDH1A1 (0.43) ALDH1A1TSHRTP53LMNAFGFR4
SCHEMBL27616294 0.92 ALDH1A1 (0.50) ALDH1A1TSHRTP53LMNAFGFR4
Phorone SCHEMBL28178933 0.81 LMNA (0.56) ALDH1A1TSHRTP53LMNAFGFR4
SCHEMBL10380928 0.80
Phorone SCHEMBL23856063 0.80 LMNA (0.39) ALDH1A1TSHRLMNA
Phorone SCHEMBL157728 0.80 LMNA (0.39) ALDH1A1TSHRLMNA
Phorone SCHEMBL28899536 0.76 LMNA (0.36) ALDH1A1TSHRLMNA
Phorone SCHEMBL27801489 0.76 LMNA (0.36) ALDH1A1TSHRLMNA
Phorone SCHEMBL32672539 0.76 LMNA (0.36) ALDH1A1TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119930964-A Photosensitive resin and closed-loop recovery and circulation 3D printing method thereof 浙江大学 2025-05-06 CN claimed
CN-119930964-A Photosensitive resin and closed-loop recovery and circulation 3D printing method thereof 浙江大学 2025-05-06 CN disclosed
US-20130246284-A1 Property-Space Similarity Modeling THE PROCTER & GAMBLE COMPANY (US) 2013-09-19 US disclosed
EP-2452294-A2 PROPERTY-SPACE SIMILARITY MODELING The Procter & Gamble Company (US) 2012-05-16 EP disclosed
US-20120101862-A1 Property-Space Similarity Modeling THE PROCTER & GAMBLE COMPANY 2012-04-26 US disclosed
WO-2010020892-A2 PROPERTY-SPACE SIMILARITY MODELING THE PROCTER & GAMBLE COMPANY (US) 2010-02-25 WO disclosed