SCHEMBL3405503

SCHEMBL3405503

CC(C)Oc1c(CCC(=O)O)cccc1NS(C)(=O)=O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 6/20 0.42
▸ ALDH1A1 P00352 4/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ HPGD P15428 2/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ PTGDR Q13258 1/20 0.39
▸ FFAR4 Q5NUL3 2/20 0.39
▸ PTGER1 P34995 1/20 0.39
▸ PTGER4 P35408 1/20 0.39
▸ PTGER3 P43115 1/20 0.39
▸ PTGER2 P43116 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ KEAP1 Q14145 1/20 0.38
▸ NFE2L2 Q16236 1/20 0.38
▸ MMP2 P08253 1/20 0.37
▸ RCE1 Q9Y256 1/20 0.37
▸ PTGS2 P35354 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
SCHEMBL3430522 0.81 LMNA (0.43) NR3C1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL3403005 0.81 NR3C1 (0.43) NR3C1PTGER1PTGER4PTGER3PTGER2
SCHEMBL3427338 0.79 MTNR1A (0.40) NR3C1ALDH1A1KDM4EHPGDPTGER1
SCHEMBL3407322 0.75 CTSG (0.48) ALDH1A1HPGDPTGDRFFAR4PTGER1
SCHEMBL3404910 0.72 EPHX2 (0.45) PTGDRFFAR4
SCHEMBL8023122 0.69 FFAR4 (0.61) ALDH1A1KDM4EPTGDRFFAR4PTGER1
SCHEMBL1405235 0.68 ALDH1A1 (0.50) NR3C1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL12474926 0.68 KMT2A (0.54) NR3C1ALDH1A1KDM4EHPGDL3MBTL1
SCHEMBL5112565 0.68 THRA (0.63) NR3C1FFAR4
SCHEMBL7888388 0.68 PTGS2 (0.54) ALDH1A1KDM4EHPGDL3MBTL1KMT2A

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-8487121-B2 Chromane derivatives as TRPV3 modulators GLENMARK PHARMACEUTICALS S.A. (CH) 2013-07-16 — — US disclosed
CN-103183660-A Chromane derivative used as TRPV3 (transient receptor potential vanilloid 3) conditioning agent GLENMARK PHARMACEUTICALS SA 2013-07-03 — — CN 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 NR3C1 403/4885ALDH1A1 3317/4885KDM4E 3601/4885

“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.

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