SCHEMBL17593113

SCHEMBL17593113

COC(=O)[C@@H]1C[C@H]1COc1ccc(Br)cc1OC

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA1 P00915 12/20 0.45
CA2 P00918 12/20 0.45
CA9 Q16790 8/20 0.45
CA12 O43570 7/20 0.45
FFAR4 Q5NUL3 2/20 0.42
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTT P42858 2/20 0.40

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
SCHEMBL17593112 1.00 CA1 (0.45) CA1CA2CA9CA12FFAR4
SCHEMBL17592707 0.84 PTGDR2 (0.52) FFAR4KDM4EMEN1ALDH1A1KMT2A
SCHEMBL17592706 0.84 PTGDR2 (0.52) FFAR4KDM4EMEN1ALDH1A1KMT2A
SCHEMBL17593056 0.83 MEN1 (0.41) CA1CA2CA9CA12FFAR4
SCHEMBL17593054 0.83 MEN1 (0.41) CA1CA2CA9CA12FFAR4
SCHEMBL17592714 0.80 LSS (0.48) FFAR4KDM4ESMN1; SMN2
SCHEMBL17593115 0.80 LSS (0.48) FFAR4KDM4ESMN1; SMN2
SCHEMBL17592713 0.80 LSS (0.48) FFAR4KDM4ESMN1; SMN2
SCHEMBL19321721 0.80 LSS (0.48) FFAR4KDM4ESMN1; SMN2
SCHEMBL19321718 0.80 LSS (0.48) FFAR4KDM4ESMN1; SMN2

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
EP-3191454-B1 CYCLOPROPANECARBOXYLIC ACID GPR120 MODULATORS BRISTOL MYERS SQUIBB CO (US) 2018-10-24 EP disclosed
US-9938222-B2 Cyclopropanecarboxylic acid GPR120 modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2018-04-10 US disclosed
US-20170253554-A1 CYCLOPROPANECARBOXYLIC ACID GPR120 MODULATORS BRISTOL MYERS SQUIBB CO (US) 2017-09-07 US disclosed
EP-3191454-A1 CYCLOPROPANECARBOXYLIC ACID GPR120 MODULATORS Bristol-Myers Squibb Company (US) 2017-07-19 EP disclosed
WO-2016040222-A1 CYCLOPROPANECARBOXYLIC ACID GPR120 MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2016-03-17 WO 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-20170253554-A1 CYCLOPROPANECARBOXYLIC ACID GPR120 MODULATORS GPR88, GPBAR1, GPR68 CA1 2808/4885CA2 521/4885CA9 3107/4885

“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.