SCHEMBL16335437

SCHEMBL16335437

Cc1cc2c(cc1Br)OC(C)(C)CC2NC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 17/20 0.41
CFTR P13569 1/20 0.39
CYP2D6 P10635 1/20 0.38
SIRT2 Q8IXJ6 2/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL17762894 0.85 SIRT2 (0.48) TRPV1CFTRCYP2D6SIRT2CYP3A4
SCHEMBL23363361 0.83 TRPV1 (0.56) TRPV1CFTRCYP2D6CYP3A4
SCHEMBL23363387 0.83 TRPV1 (0.46) TRPV1SIRT2CYP3A4
SCHEMBL2318940 0.76 CFTR (0.61) TRPV1CFTRCYP2D6CYP3A4
SCHEMBL16334996 0.75 HTR2C (0.34)
SCHEMBL9091707 0.73 TLR3 (0.43) TRPV1
SCHEMBL619019 0.73 HDAC3 (0.43) TRPV1
SCHEMBL16381656 0.72 HTR2C (0.33)
SCHEMBL23363272 0.70 TRPV1 (0.50) TRPV1CFTRCYP2D6CYP3A4
SCHEMBL23363355 0.69 TRPV1 (0.52) TRPV1CFTRCYP2D6CYP3A4

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-9790231-B2 Chromane and chromene derivatives and their use as CRAC modulators LUPIN LIMITED (IN) 2017-10-17 US disclosed
US-20160137659-A1 CHROMANE AND CHROMENE DERIVATIVES AND THEIR USE AS CRAC MODULATORS LUPIN LIMITED (IN) 2016-05-19 US disclosed
EP-3013810-A1 CHROMANE AND CHROMENE DERIVATIVES AND THEIR USE AS CRAC MODULATORS Lupin Limited (IN) 2016-05-04 EP disclosed
WO-2014207648-A1 CHROMANE AND CHROMENE DERIVATIVES AND THEIR USE AS CRAC MODULATORS LUPIN LIMITED (IN) 2014-12-31 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-20160137659-A1 CHROMANE AND CHROMENE DERIVATIVES AND THEIR USE AS CRAC MODULATORS ORAI1, RYR2, RYR1 TRPV1 30/4885CFTR 251/4885CYP2D6 1143/4885

“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.