SCHEMBL10272415

SCHEMBL10272415

CCCc1cccc(Oc2ccc(F)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 2/20 0.50
LTA4H P09960 1/20 0.44
EPHX2 P34913 1/20 0.44
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MPO P05164 1/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CETP P11597 1/20 0.42
CACNA1B Q00975 1/20 0.42
MMP13 P45452 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
MAOB P27338 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
SCHEMBL10106190 0.89 FDFT1 (0.53) FDFT1LTA4HCETP
SCHEMBL10272416 0.88 FDFT1 (0.49) FDFT1TSHRHSD17B10ALDH1A1KDM4E
SCHEMBL25381878 0.88 FDFT1 (0.57) FDFT1TSHRHSD17B10ALDH1A1KDM4E
SCHEMBL26218121 0.88 TAAR1 (0.50) FDFT1TSHRHSD17B10ALDH1A1KDM4E
SCHEMBL8429859 0.86 FDFT1 (0.46) FDFT1LTA4HEPHX2TSHRHSD17B10
SCHEMBL1696397 0.86 KDM4E (0.55) FDFT1LTA4HTSHRHSD17B10ALDH1A1
SCHEMBL14127822 0.85 FFAR1 (0.52) FDFT1TSHRHSD17B10ALDH1A1KDM4E
Ammonia Solution, Strong SCHEMBL27879510 0.84 KDM4E (0.54) FDFT1LTA4HTSHRHSD17B10ALDH1A1
SCHEMBL21770981 0.84 KDM4E (0.54) FDFT1LTA4HTSHRHSD17B10ALDH1A1
SCHEMBL15177141 0.83 FDFT1 (0.45) FDFT1LTA4HEPHX2ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9518000-B2 Bicyclo [2.2.1] acid GPR120 modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2016-12-13 US disclosed
US-20160016880-A1 BICYCLO [2.2.1] ACID GPR120 MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2016-01-21 US disclosed
US-8148367-B2 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-04-03 US disclosed
US-20100228026-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-09-09 US disclosed
US-20070004704-A1 Such as 6-Methyl-2-[4-(5-methyl-2-phenyl-oxazol-4-ylmethoxy)-benzenesulfonylamino]-benzoic acid which binds Peroxisome Proliferator-Activated Receptors; conditions in which impaired glucose tolerance, hyperglycemia and insulin resistance are implicated, such as type-1 and type-2 diabetes, and Syndrome X NOVARTIS AG (CH) 2007-01-04 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 (3 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-20160016880-A1 BICYCLO [2.2.1] ACID GPR120 MODULATORS GPR180, GPR88, GPBAR1 FDFT1 2633/4885LTA4H 1410/4885EPHX2 1748/4885
US-20070004704-A1 Such as 6-Methyl-2-[4-(5-methyl-2-phenyl-oxazol-4-ylmethoxy)-benzenesulfonylamino]-benzoic acid which binds Peroxisome Proliferator-Activated Receptors; conditions in which impaired glucose tolerance, hyperglycemia and insulin resistance are implicated, such as type-1 and type-2 diabetes, and Syndrome X PPARG, GPR119, PPARA FDFT1 2060/4885LTA4H 2450/4885EPHX2 2952/4885
US-20100228026-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF REN, AGTR2, AGTR1 FDFT1 3194/4885LTA4H 1644/4885EPHX2 2465/4885

“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.