SCHEMBL9541562

SCHEMBL9541562

C=CCCCCCCC(O)CCCCCCCCC

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.67
ALDH1A1 P00352 2/20 0.52
USP2 O75604 2/20 0.50
FFAR4 Q5NUL3 2/20 0.50
FFAR1 O14842 2/20 0.50
CYP3A4 P08684 2/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
GPR84 Q9NQS5 5/20 0.47
FAAH O00519 2/20 0.45
NFKB1 P19838 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL11741042 1.00 TSHR (0.67) TSHRALDH1A1USP2FFAR4FFAR1
SCHEMBL11698081 1.00 TSHR (0.67) TSHRALDH1A1USP2FFAR4FFAR1
SCHEMBL9542809 1.00 TSHR (0.67) TSHRALDH1A1USP2FFAR4FFAR1
SCHEMBL13219935 1.00 TSHR (0.67) TSHRALDH1A1USP2FFAR4FFAR1
SCHEMBL19721792 1.00 TSHR (0.67) TSHRALDH1A1USP2FFAR4FFAR1
SCHEMBL14919581 1.00 TSHR (0.67) TSHRALDH1A1USP2FFAR4FFAR1
SCHEMBL15635268 1.00 TSHR (0.67) TSHRALDH1A1USP2FFAR4FFAR1
SCHEMBL3032108 1.00 TSHR (0.67) TSHRALDH1A1USP2FFAR4FFAR1
SCHEMBL20500832 1.00 TSHR (0.67) TSHRALDH1A1USP2FFAR4FFAR1
SCHEMBL9015418 1.00 TSHR (0.67) TSHRALDH1A1USP2FFAR4FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119233757-A Agricultural composition 奥罗农业欧洲股份公司 2024-12-31 CN disclosed
CN-107849209-B Urea urethanes for rheology control 毕克化学有限公司 2020-12-15 CN disclosed
CN-103348008-A Gene disruptors for the production of fatty acyl-CoA derivatives CODEXIS INC 2013-10-09 CN disclosed
WO-1993002666-A1 SELF-STABILISED MULTIPHASE EMUSION STRUCTURES THOREL JEAN NOEL (FR) 1993-02-18 WO disclosed
US-4515768-A STABILIZER AGAINST THERMAL DECOMPOSITION AIRWICK INDUSTRIES, INC. (US) 1985-05-07 US disclosed
EP-0036385-B1 INSECTICIDAL VAPOUR-EMITTING COMPOSITIONS ON THE BASIS OF PYRETHRINOIDS Airwick AG (CH) 1984-05-02 EP disclosed
EP-0037375-A1 Insecticidal-vapours emitting device Airwick AG (CH) 1981-10-07 EP disclosed
EP-0036385-A2 Insecticidal vapour-emitting compositions on the basis of pyrethrinoids Airwick AG (CH) 1981-09-23 EP disclosed