SCHEMBL4176955

SCHEMBL4176955

Cc1ccc(C(=O)O)cc1NS(C)(=O)=O

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NEU3 Q9UQ49 1/20 0.56
NPC1 O15118 2/20 0.53
FABP4 P15090 1/20 0.52
KMT2A Q03164 3/20 0.50
KDM4E B2RXH2 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MEN1 O00255 1/20 0.49
AKR1C3 P42330 1/20 0.49
CYP2C9 P11712 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
RAD52 P43351 1/20 0.47
SELL P14151 1/20 0.47
SELP P16109 1/20 0.47
ALDH1A1 P00352 2/20 0.46
CASR P41180 1/20 0.46
TSHR P16473 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL29791318 1.00 NEU3 (0.56) NEU3NPC1FABP4KMT2AKDM4E
SCHEMBL5329433 0.86 NEU3 (0.60) NEU3NPC1KMT2AKDM4ESMN1; SMN2
SCHEMBL567311 0.86 NEU3 (0.63) NEU3NPC1KMT2AKDM4ESMN1; SMN2
SCHEMBL29791247 0.86 NEU3 (0.63) NEU3NPC1KMT2AKDM4ESMN1; SMN2
SCHEMBL4175701 0.83 KDM4E (0.72) NPC1KMT2AKDM4ESMN1; SMN2HSD17B10
SCHEMBL6307782 0.83 KDM4E (0.62) NEU3KMT2AKDM4ESMN1; SMN2HSD17B10
SCHEMBL15894590 0.83 ADRB3 (0.58) NEU3KMT2AKDM4ESMN1; SMN2HSD17B10
SCHEMBL3526841 0.81 ALDH1A1 (0.60) NEU3NPC1FABP4KMT2AKDM4E
SCHEMBL11225114 0.81 NEU3 (0.58) NEU3NPC1KMT2AKDM4ESMN1; SMN2
SCHEMBL17331322 0.81 CYP2C9 (0.60) FABP4KMT2AKDM4EHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020017934-A1 COLORED CURABLE RESIN COMPOSITION, COLOR FILTER, AND DISPLAY APPARATUS 동우 화인켐 주식회사 2020-01-23 WO disclosed
US-9308200-B2 Dry powder formulation comprising a phosphodiesterase inhibitor CHIESI FARMACEUTICI S.P.A. (IT) 2016-04-12 US disclosed
US-20150342936-A1 DRY POWDER FORMULATION COMPRISING A PHOSPHODIESTERASE INHIBITOR CHIESI FARMACEUTICI S.P.A. (IT) 2015-12-03 US disclosed
US-9132121-B2 Dry powder formulation comprising a phosphodiesterase inhibitor CHIESI FARMACEUTICI S.P.A. (IT) 2015-09-15 US disclosed
US-9051296-B2 Aryl carboxamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2015-06-09 US disclosed
US-20120232052-A1 ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-09-13 US disclosed
US-20090105305-A1 Therapeutic Agents - 550 ASTRAZENECA AB (SE) 2009-04-23 US disclosed
US-20090105305-A1 Therapeutic Agents - 550 ASTRAZENECA AB (SE) 2009-04-23 US disclosed
US-20090105305-A1 Therapeutic Agents - 550 ASTRAZENECA AB (SE) 2009-04-23 US disclosed
WO-2008075070-A1 SULFONAMIDE DERIVATIVES FOR THERAPEUTIC USE AS FATTY ACID SYNTHASE INHIBITORS ASTRAZENECA AB (SE) 2008-06-26 WO disclosed
EP-1742105-A2 Photothermographic material Fuji Photo Film Co., Ltd. (JP) 2007-01-10 EP 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 (3 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-20090105305-A1 Therapeutic Agents - 550 FABP4, GPR119, FASN NEU3 967/4885NPC1 233/4885FABP4 1/4885
US-20150342936-A1 DRY POWDER FORMULATION COMPRISING A PHOSPHODIESTERASE INHIBITOR PDE3A, PDE5A, PDE2A NEU3 1737/4885NPC1 3602/4885FABP4 4054/4885
US-20120232052-A1 ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS SCN1B, SCN1A, SCN2B NEU3 1690/4885NPC1 1433/4885FABP4 4181/4885

“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.