SCHEMBL7126085

SCHEMBL7126085

C=CCCC(O)C(O)CC

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.39
ALDH1A1 P00352 1/20 0.36
LMNA P02545 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
SCHEMBL7125615 0.86 TSHR (0.44) TSHRALDH1A1LMNA
SCHEMBL29597478 0.84 TSHR (0.44) TSHRALDH1A1LMNA
SCHEMBL29552118 0.83 LMNA (0.43) TSHRALDH1A1LMNA
SCHEMBL17213406 0.81 TSHR (0.36) TSHRALDH1A1
SCHEMBL22367005 0.81 TSHR (0.36) TSHRALDH1A1
SCHEMBL6437221 0.77 TSHR (0.32) TSHRLMNA
SCHEMBL2470235 0.77
SCHEMBL172769 0.77 USP2 (0.37) TSHRALDH1A1LMNA
SCHEMBL7120485 0.77
SCHEMBL22367010 0.76 TSHR (0.36) TSHRALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030153483-A1 Concentrated, stable fabric softening composition TRINH TOAN (US) 2003-08-14 US claimed
EP-0842250-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1998-05-20 EP claimed
WO-1997003169-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 WO claimed