SCHEMBL8736615

SCHEMBL8736615

CCCCCCCCCC1(CC(=O)O)CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.52
ALDH1A1 P00352 3/20 0.52
CYP1A2 P05177 2/20 0.52
USP2 O75604 1/20 0.52
LMNA P02545 1/20 0.52
BLM P54132 1/20 0.52
CACNA2D1 P54289 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 2/20 0.41
PPARG P37231 6/20 0.41
PPARD Q03181 6/20 0.41
PPARA Q07869 6/20 0.41
GPR84 Q9NQS5 5/20 0.41
HDAC11 Q96DB2 5/20 0.41
TLR2 O60603 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
FABP4 P15090 2/20 0.41
PTPN1 P18031 2/20 0.41
SLC22A6 Q4U2R8 1/20 0.41

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
SCHEMBL8736487 1.00 TSHR (0.52) TSHRALDH1A1CYP1A2USP2LMNA
SCHEMBL8735253 1.00 TSHR (0.52) TSHRALDH1A1CYP1A2USP2LMNA
SCHEMBL10534570 1.00 TSHR (0.52) TSHRALDH1A1CYP1A2USP2LMNA
SCHEMBL27274533 1.00 TSHR (0.52) TSHRALDH1A1CYP1A2USP2LMNA
SCHEMBL27272549 1.00 TSHR (0.52) TSHRALDH1A1CYP1A2USP2LMNA
SCHEMBL27270393 1.00 TSHR (0.52) TSHRALDH1A1CYP1A2USP2LMNA
SCHEMBL8736846 0.98 TSHR (0.53) TSHRALDH1A1CYP1A2USP2LMNA
SCHEMBL8733717 0.98 TSHR (0.48) TSHRALDH1A1CYP1A2USP2LMNA
SCHEMBL8733702 0.98 TSHR (0.48) TSHRALDH1A1CYP1A2USP2LMNA
SCHEMBL8735260 0.98 TSHR (0.48) TSHRALDH1A1CYP1A2USP2LMNA

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
EP-0413305-B1 Chlorosulfonated polyethylene polymer composition TOSOH CORP (JP) 1998-04-08 EP disclosed
US-5344861-A Polymer blend with organic acid, phenylamine, phenylenediamine and acid acceptor with vulcanization agent TOSOH CORPORATION (JP) 1994-09-06 US disclosed
EP-0413305-A1 Chlorosulfonated polyethylene polymer composition TOSOH CORPORATION (JP) 1991-02-20 EP disclosed