SCHEMBL3179145

SCHEMBL3179145

C=CCCCCCOC1CCCCC1OCCCCCC=C

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.41
LPAR3 Q9UBY5 2/20 0.40
LPAR2 Q9HBW0 1/20 0.40
TSHR P16473 2/20 0.37
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
ABCC4 O15439 1/20 0.32
MAPT P10636 1/20 0.32
TRPA1 O75762 1/20 0.31
OPRM1 P35372 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
SCHEMBL3179718 0.98 SLC2A1 (0.38) SLC2A1LPAR3LPAR2TSHRALDH1A1
SCHEMBL3191817 0.92 SLC2A1 (0.33) SLC2A1LPAR3LPAR2TSHRALDH1A1
SCHEMBL28455816 0.83 CA2 (0.32) OPRM1
SCHEMBL31267671 0.82 NPC1 (0.39) SLC2A1LPAR3LPAR2TSHRALDH1A1
SCHEMBL31267589 0.80 NPC1 (0.42) SLC2A1LPAR3LPAR2TSHRALDH1A1
SCHEMBL8459105 0.77 MEN1 (0.47) SLC2A1LPAR3LPAR2TSHR
SCHEMBL10486013 0.77 MEN1 (0.47) SLC2A1LPAR3LPAR2TSHR
SCHEMBL21667954 0.77 MEN1 (0.47) SLC2A1LPAR3LPAR2TSHR
SCHEMBL21668019 0.77 MEN1 (0.47) SLC2A1LPAR3LPAR2TSHR
SCHEMBL16264036 0.77 MEN1 (0.47) SLC2A1LPAR3LPAR2TSHR

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
US-20100022461-A1 Novel Derivatives of Cyclic Compound And The Use Thereof WONKISOPHARM CO., LTD. (KR) 2010-01-28 US claimed
CN-106309421-B Pharmaceutical composition and cosmetic composition 沃凯索法株式会社 2020-08-25 CN disclosed
US-8420853-B2 Derivatives of cyclic compound and the use thereof Wonkisopharm Co., Ltd (KR) 2013-04-16 US disclosed
US-20100022461-A1 Novel Derivatives of Cyclic Compound And The Use Thereof WONKISOPHARM CO., LTD. (KR) 2010-01-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100022461-A1 Novel Derivatives of Cyclic Compound And The Use Thereof TYR, MC1R, PDE7A SLC2A1 3555/4885LPAR3 2289/4885LPAR2 2030/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.