SCHEMBL3404910

SCHEMBL3404910

CC(C)Oc1ccc(NS(C)(=O)=O)cc1CCC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.45
▸ NR1H4 Q96RI1 1/20 0.45
▸ FFAR4 Q5NUL3 3/20 0.45
▸ FFAR1 O14842 1/20 0.45
▸ P2RX3 P56373 4/20 0.42
▸ ADRB3 P13945 1/20 0.41
▸ PTGDR Q13258 2/20 0.41
▸ FOS P01100 1/20 0.40
▸ JUN P05412 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.39
▸ SLC6A4 P31645 3/20 0.39
▸ SLC6A2 P23975 1/20 0.39
▸ SLC6A3 Q01959 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ HTR6 P50406 1/20 0.39
▸ RORC P51449 1/20 0.39

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
SCHEMBL3405503 0.72 NR3C1 (0.42) FFAR4PTGDR
SCHEMBL8023122 0.72 FFAR4 (0.61) FFAR4FFAR1PTGDRNPSR1
SCHEMBL6353967 0.72 HPGD (0.48) SLC6A4SLC6A2SLC6A3KCNH2HTR6
SCHEMBL657740 0.70 ALDH1A1 (0.64) FFAR4FFAR1NPSR1KCNH2
SCHEMBL9370964 0.70 SPR (0.64) NPSR1HTR6
SCHEMBL6500179 0.69 FABP4 (0.57) FFAR1HTR6
SCHEMBL11366139 0.68 HTR6 (0.46) FFAR4FFAR1NPSR1HTR6
SCHEMBL3555186 0.68 NPC1 (0.51) FFAR1KCNH2
SCHEMBL10781933 0.67 GRIN1 (0.46) EPHX2NR1H4KCNH2
SCHEMBL2960332 0.67 JUN (0.55) FFAR4FFAR1PTGDRFOSJUN

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 EPHX2 2983/4885NR1H4 457/4885FFAR4 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.

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