SCHEMBL17840231

SCHEMBL17840231

FC(F)(F)Oc1ccc(-c2ccccc2-c2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.50
FFAR4 Q5NUL3 2/20 0.47
FFAR1 O14842 1/20 0.47
KIF11 P52732 2/20 0.44
NISCH Q9Y2I1 1/20 0.44
ABL1 P00519 1/20 0.44
ABCB1 P08183 1/20 0.44
BCR P11274 1/20 0.44
SCN5A Q14524 2/20 0.44
MAPT P10636 1/20 0.42
EPHX2 P34913 1/20 0.42
NOTUM Q6P988 1/20 0.42
SERPINE1 P05121 2/20 0.42
OPRM1 P35372 1/20 0.42
OPRK1 P41145 1/20 0.42
ACP1 P24666 1/20 0.42
HCRTR1 O43613 1/20 0.42
HCRTR2 O43614 1/20 0.42

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
SCHEMBL16925983 0.88 GPR3 (0.45) GPR3FFAR4FFAR1KIF11NISCH
SCHEMBL4150746 0.86 ALDH1A1 (0.52) GPR3FFAR4FFAR1KIF11NISCH
SCHEMBL5535236 0.86 S1PR1 (0.44) GPR3FFAR4FFAR1KIF11SCN5A
SCHEMBL17454635 0.86 GPR3 (0.44) GPR3FFAR4FFAR1KIF11NISCH
SCHEMBL15756982 0.86 GPR3 (0.44) GPR3FFAR4FFAR1KIF11NISCH
SCHEMBL5535234 0.86 GPR3 (0.44) GPR3FFAR4FFAR1KIF11NISCH
SCHEMBL396792 0.86 ALDH1A1 (0.52) GPR3FFAR4FFAR1KIF11NISCH
SCHEMBL18293362 0.84 KIF11 (0.50) KIF11NISCHSCN5ASERPINE1ACP1
SCHEMBL306823 0.84 KIF11 (0.50) KIF11NISCHSCN5ASERPINE1ACP1
SCHEMBL28910204 0.82 SERPINE1 (0.49) KIF11NISCHSCN5ASERPINE1ACP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9828339-B2 Biphenyl derivatives and methods for preparing same DONG-A ST CO., LTD (KR) 2017-11-28 US disclosed
US-20160176816-A1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME DONG-A ST CO., LTD (KR) 2016-06-23 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-20160176816-A1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME CHRM2, CHRM3, CHRM5 GPR3 34/4885FFAR4 399/4885FFAR1 614/4885

“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.