SCHEMBL12537708

SCHEMBL12537708

O=Cc1nc(-c2cc(Cl)cc(Cl)c2)ccc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV3 Q8NET8 2/20 0.40
▸ ADORA2A P29274 3/20 0.34
▸ ADORA1 P30542 3/20 0.34
▸ ADORA2B P29275 1/20 0.34
▸ KMO O15229 3/20 0.33
▸ KDM1A O60341 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ AKR1C3 P42330 2/20 0.31
▸ AKR1C2 P52895 2/20 0.31
▸ APP P05067 2/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ GRM5 P41594 1/20 0.31
▸ MAPK13 O15264 1/20 0.31
▸ RAF1 P04049 1/20 0.31
▸ MAPK12 P53778 1/20 0.31
▸ MAPK11 Q15759 1/20 0.31

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
SCHEMBL12538423 0.85 KMO (0.44) TRPV3KMOMAOBMAPK13
SCHEMBL12538500 0.82 TRPV3 (0.43) TRPV3KMOKDM4EALDH1A1GAA
SCHEMBL12539005 0.79 TRPV3 (0.43) TRPV3KMOKDM1AMAOB
SCHEMBL12538116 0.79 RAB9A (0.40) TRPV3MAOBKDM4EALDH1A1L3MBTL1
SCHEMBL12537997 0.77 KMO (0.46) TRPV3KMOMAOBKDM4EALDH1A1
SCHEMBL12615576 0.76 TRPV3 (0.82) TRPV3
SCHEMBL25392607 0.74 KMO (0.38) TRPV3KMOKDM4EALDH1A1
SCHEMBL31282190 0.74 KMO (0.38) TRPV3KMOKDM4EALDH1A1
SCHEMBL29736642 0.74 HSD17B10 (0.34) KDM4EALDH1A1GAAL3MBTL1
SCHEMBL20268024 0.74 HSD17B10 (0.34) KDM4EALDH1A1GAAL3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9012651-B2 TRPV3 modulators ABBVIE INC. (US) 2015-04-21 — — US disclosed
US-20120245124-A1 TRPV3 Modulators ABBOTT LABORATORIES (US) 2012-09-27 — — US disclosed
WO-2012129491-A1 TRPV3 MODULATORS ABBOTT LABORATORIES (US) 2012-09-27 — — 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-20120245124-A1 TRPV3 Modulators TRPV3, TRPV2, TRPV1 TRPV3 1/4885ADORA2A 492/4885ADORA1 341/4885

“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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