SCHEMBL3407322

SCHEMBL3407322

COc1cccc(CCC(=O)O)c1OC(C)C

nearest known ligand 0.76

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSG P08311 1/20 0.48
CMA1 P23946 1/20 0.48
FFAR4 Q5NUL3 3/20 0.46
ALDH1A1 P00352 1/20 0.45
HPGD P15428 2/20 0.45
HTT P42858 1/20 0.45
LMNA P02545 1/20 0.44
PTGER1 P34995 1/20 0.42
PTGER4 P35408 1/20 0.42
PTGER3 P43115 1/20 0.42
PTGER2 P43116 1/20 0.42
PTGDR Q13258 2/20 0.42
KMT2A Q03164 1/20 0.42
POLB P06746 2/20 0.41
FFAR1 O14842 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
SCHEMBL490691 0.86 CTSG (0.56) CTSGCMA1FFAR4ALDH1A1LMNA
SCHEMBL7885276 0.85 CTSG (0.55) CTSGCMA1FFAR4ALDH1A1LMNA
SCHEMBL3408740 0.81 KMT2A (0.54) CTSGCMA1FFAR4HPGDLMNA
SCHEMBL8023122 0.80 FFAR4 (0.61) FFAR4ALDH1A1LMNAPTGER1PTGER4
SCHEMBL30753448 0.80 CYP4F2 (0.41) CTSGCMA1ALDH1A1HPGDHTT
SCHEMBL21715451 0.80 CYP4F2 (0.41) CTSGCMA1ALDH1A1HPGDHTT
SCHEMBL27908883 0.79 PTGDR (0.53) FFAR4ALDH1A1HPGDLMNAPTGDR
SCHEMBL1251863 0.79 TAAR1 (0.59)
SCHEMBL3697457 0.79 LMNA (0.50) FFAR4ALDH1A1LMNA
SCHEMBL362209 0.78 LMNA (0.59) HPGDLMNAPOLBFFAR1

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-8487121-B2 Chromane derivatives as TRPV3 modulators GLENMARK PHARMACEUTICALS S.A. (CH) 2013-07-16 US disclosed
US-20100311778-A1 CHROMANE DERIVATIVES AS TRPV3 MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2010-12-09 US disclosed
EP-2254879-A2 CHROMANE DERIVATIVES AS TRPV3 MODULATORS Glenmark Pharmaceuticals S.A. (CH) 2010-12-01 EP disclosed
WO-2009084034-A2 CHROMANE DERIVATIVES AS TRPV3 MODULATORS GLENMARK PHARMACEUTICALS, S. A. (CH) 2009-07-09 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-20100311778-A1 CHROMANE DERIVATIVES AS TRPV3 MODULATORS TRPV3, TRPV2, TRPV1 CTSG 2628/4885CMA1 1807/4885FFAR4 181/4885

“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.