SCHEMBL1094396

SCHEMBL1094396

O=C(O)N1CCC(c2cc(C(F)(F)F)ccc2O)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 5/20 0.47
PTGDR2 Q9Y5Y4 1/20 0.47
TRPV1 Q8NER1 1/20 0.44
IDO1 P14902 2/20 0.43
SLC9A1 P19634 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.42
EGLN1 Q9GZT9 2/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
QDPR P09417 1/20 0.40
KCNH2 Q12809 1/20 0.39
MCHR1 Q99705 1/20 0.39
TDO2 P48775 1/20 0.39
SCD5 Q86SK9 1/20 0.38

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
SCHEMBL15012563 0.85 RBP4 (0.46) RBP4PTGDR2TRPV1IDO1SLC9A1
SCHEMBL23858293 0.83 TRPV1 (0.55) RBP4PTGDR2TRPV1IDO1SLC9A1
SCHEMBL19974334 0.83 RBP4 (0.45) RBP4PTGDR2TRPV1IDO1SLC9A1
SCHEMBL1093627 0.82 STS (0.50) TRPV1
SCHEMBL17141453 0.82 CHRNB2 (0.47) PTGDR2MRGPRX4MEN1KMT2A
SCHEMBL1094926 0.82 PTGDR2 (0.55) RBP4PTGDR2TRPV1IDO1SLC9A1
SCHEMBL27642929 0.81 SCD5 (0.44) RBP4PTGDR2SLC9A1MEN1KMT2A
SCHEMBL3476260 0.80 SIGMAR1 (0.37) RBP4PTGDR2TRPV1IDO1MRGPRX4
SCHEMBL9861406 0.79 PTGDR2 (0.52) PTGDR2MEN1KMT2A
SCHEMBL1094791 0.78 PTGDR2 (0.45) PTGDR2IDO1MEN1KMT2AQDPR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170137415-A1 SULFONAMIDE COMPOUNDS AS VOLTAGE GATED SODIUM CHANNEL MODULATORS LUPIN LIMITED (IN) 2017-05-18 US disclosed
EP-3126360-A1 SULFONAMIDE COMPOUNDS AS VOLTAGE GATED SODIUM CHANNEL MODULATORS Lupin Limited (IN) 2017-02-08 EP disclosed
WO-2015151001-A1 SULFONAMIDE COMPOUNDS AS VOLTAGE GATED SODIUM CHANNEL MODULATORS LUPIN LIMITED (IN) 2015-10-08 WO disclosed
EP-2385938-B1 SULFONAMIDE DERIVATIVES PFIZER LTD (GB) 2015-03-04 EP disclosed
US-8907101-B2 Sulfonamide derivatives PFIZER LIMITED (GB) 2014-12-09 US disclosed
US-20130338111-A1 Sulfonamide Derivatives ICAGEN, INC. (US) 2013-12-19 US disclosed
US-8541588-B2 Sulfonamide derivatives PFIZER LIMITED (GB) 2013-09-24 US disclosed
US-20120149679-A1 Sulfonamide Derivatives ICAGEN, INC. 2012-06-14 US disclosed
US-8153814-B2 Sulfonamide derivatives PFIZER LIMITED (GB) 2012-04-10 US disclosed
EP-2385938-A1 SULFONAMIDE DERIVATIVES Pfizer Limited (GB) 2011-11-16 EP disclosed
US-8040476-B2 Display device and method of producing the same MITSUBISHI ELECTRIC CORPORATION (JP) 2011-10-18 US disclosed
US-20100197655-A1 SULFONAMIDE DERIVATIVES Pfizer Limited Icagen, Inc. 2010-08-05 US disclosed
WO-2010079443-A1 SULFONAMIDE DERIVATIVES PFIZER LIMITED (GB) 2010-07-15 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 (4 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-20100197655-A1 SULFONAMIDE DERIVATIVES SULT2A1, SULT1A1, TPST2 RBP4 3684/4885PTGDR2 619/4885TRPV1 5/4885
US-20130338111-A1 Sulfonamide Derivatives SULT2A1, SULT1A1, TPST2 RBP4 3684/4885PTGDR2 619/4885TRPV1 5/4885
US-20170137415-A1 SULFONAMIDE COMPOUNDS AS VOLTAGE GATED SODIUM CHANNEL MODULATORS SCN7A, SCN1A, SCN5A RBP4 4664/4885PTGDR2 2653/4885TRPV1 23/4885
US-20120149679-A1 Sulfonamide Derivatives SULT2A1, SULT1A1, TPST2 RBP4 3684/4885PTGDR2 619/4885TRPV1 5/4885

“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.