SCHEMBL8914701

SCHEMBL8914701

[CH2]CCCCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.54
ALDH1A1 P00352 8/20 0.50
TSHR P16473 3/20 0.50
LMNA P02545 2/20 0.50
KMT2A Q03164 3/20 0.49
MAPK1 P28482 3/20 0.49
NPSR1 Q6W5P4 3/20 0.49
MEN1 O00255 2/20 0.49
CYP1A2 P05177 2/20 0.49
CYP3A4 P08684 2/20 0.49
BLM P54132 2/20 0.49
ATM Q13315 2/20 0.49
HIF1A Q16665 2/20 0.49
ALOX15 P16050 2/20 0.49
GMNN O75496 1/20 0.49
GABBR2 O75899 1/20 0.49
TP53 P04637 1/20 0.49
CYP2C9 P11712 1/20 0.49
NFKB1 P19838 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
SCHEMBL27404586 0.98 GAA (0.52) GAAALDH1A1TSHRLMNAKMT2A
SCHEMBL5610220 0.94 GAA (0.55) GAAALDH1A1TSHRLMNAKMT2A
SCHEMBL8751536 0.90 ALDH1A1 (0.59) GAAALDH1A1TSHRLMNAKMT2A
SCHEMBL8751503 0.88 ALDH1A1 (0.57) GAAALDH1A1TSHRLMNAKMT2A
SCHEMBL8751548 0.88 ALDH1A1 (0.57) GAAALDH1A1TSHRLMNAKMT2A
SCHEMBL18193749 0.88 ALDH1A1 (0.57) GAAALDH1A1TSHRLMNAKMT2A
SCHEMBL8751545 0.88 ALDH1A1 (0.57) GAAALDH1A1TSHRLMNAKMT2A
SCHEMBL3762751 0.88 ALDH1A1 (0.57) GAAALDH1A1TSHRLMNAKMT2A
SCHEMBL18193748 0.88 ALDH1A1 (0.57) GAAALDH1A1TSHRLMNAKMT2A
SCHEMBL17588977 0.88 ALDH1A1 (0.57) GAAALDH1A1TSHRLMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108264627-A A kind of low melting point spandex section 河北邦泰氨纶科技有限公司 2018-07-10 CN disclosed
CN-108264626-A A kind of high resilience spandex slice 河北邦泰氨纶科技有限公司 2018-07-10 CN disclosed
CN-108026359-A Polyester composition and mobile electronic device parts made therefrom 索尔维特殊聚合物美国有限责任公司 2018-05-11 CN disclosed
US-5624982-A BENZOTRIAZOLE COMPOUNDS FOR LIGHT STABILIZERS OF TETRAMETHYL PIPERIDINYL SEBACATE FOR STYRENE POLYMERS BAYER ANTWERPEN SA/NV (BE) 1997-04-29 US disclosed