SCHEMBL3348926

SCHEMBL3348926

Cc1ccc(-c2cccs2)o1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 1/20 0.48
ALDH1A1 P00352 11/20 0.46
KDM4E B2RXH2 9/20 0.46
HPGD P15428 5/20 0.46
MAPT P10636 3/20 0.46
TDP1 Q9NUW8 3/20 0.46
HSD17B10 Q99714 2/20 0.46
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
RAB9A P51151 5/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
NPC1 O15118 4/20 0.42
CYP1A2 P05177 3/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 1/20 0.40
ADORA2A P29274 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
SCHEMBL499141 0.84 ALDH1A1 (0.53) S1PR4ALDH1A1KDM4EHPGDMAPT
SCHEMBL22945653 0.76 ALDH1A1 (0.44) S1PR4ALDH1A1KDM4EHPGDMAPT
SCHEMBL3349294 0.76 ALDH1A1 (0.38) S1PR4ALDH1A1KDM4EHPGDMAPT
SCHEMBL18876413 0.75 ALDH1A1 (0.46) S1PR4ALDH1A1KDM4EHPGDMAPT
SCHEMBL17269675 0.75 PDE10A (0.40) ALDH1A1KDM4EHPGDMAPTTDP1
SCHEMBL18879678 0.75 KDM4E (0.46) S1PR4ALDH1A1KDM4EHPGDMAPT
SCHEMBL10287183 0.75 KDM4E (0.58) S1PR4ALDH1A1KDM4EHPGDMAPT
SCHEMBL10253758 0.75 ALDH1A1 (0.43) S1PR4ALDH1A1KDM4EHPGDMAPT
SCHEMBL28879176 0.73 ALDH1A1 (0.49) S1PR4ALDH1A1KDM4EHPGDMAPT
SCHEMBL14854115 0.73 TDP1 (0.48) S1PR4ALDH1A1KDM4EHPGDMAPT

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 55 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11289654-B2 Polymers containing furanyl crosslinkable groups and uses thereof GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2022-03-29 US disclosed
US-11193065-B2 Liquid crystal composition, method of producing the same, and retardation film constituted from the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-12-07 US disclosed
US-20200165519-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION AND RETARDATION PLATE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-05-28 US disclosed
EP-3560917-A1 POLYMER CONTAINING FURAN CROSSLINKING GROUP AND USE THEREOF Guangzhou Chinaray Optoelectronic Materials Ltd. (CN) 2019-10-30 EP disclosed
US-20190276744-A1 LIQUID CRYSTAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-09-12 US disclosed
US-10407619-B2 Liquid crystal composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-09-10 US disclosed
US-10336938-B2 Liquid crystal composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-07-02 US disclosed
WO-2019053540-A1 METHODS OF PRODUCING ALPHA, BETA-UNSATURATED CARBOXYLIC ACID SALTS FROM ALKANES AND CARBON DIOXIDE SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2019-03-21 WO disclosed
WO-2019053541-A1 ACRYLATES THROUGH OLEFIN/CARBON DIOXIDE COUPLING SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2019-03-21 WO disclosed
US-20190077762-A1 QUINOLONE COMPOUND OTSUKA PHARMA CO LTD (JP) 2019-03-14 US disclosed
US-20140302637-A1 POLYMERS BASED ON BENZODIONES BASF SE (DE) 2014-10-09 US disclosed
US-8835644-B2 Broad spectrum benzothiophene-nitrothiazolide and other antimicrobials UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2014-09-16 US disclosed
WO-2014072292-A2 POLYMERS BASED ON NAPHTHODIONES BASF SE (DE) 2014-05-15 WO disclosed
WO-2014016219-A1 DITHIENOBENZOFURAN POLYMERS AND SMALL MOLECULES FOR ELECTRONIC APPLICATION BASF SE (DE) 2014-01-30 WO disclosed
WO-2013150005-A1 DIKETOPYRROLOPYRROLE POLYMERS AND SMALL MOLECULES BASF SE (DE) 2013-10-10 WO disclosed
WO-2013149897-A1 PHENANTHRO[9,10-B]FURAN POLYMERS AND SMALL MOLECULES FOR ELECTRONIC APPLICATIONS BASF SE (DE) 2013-10-10 WO disclosed
WO-2013050401-A2 POLYMERS BASED ON BENZODIONES BASF SE (DE) 2013-04-11 WO disclosed
WO-2010045009-A1 PHENYL AND HETEROARYL SUBSTITUTED THIENO[2,3-d] PYRIMIDINES AND THEIR USE AS ADENOSINE A2a RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2010-04-22 WO disclosed
WO-2010045016-A1 HETEROCYCLYL AND CYCLOALKYL SUBSTITUTED THIENO [2,3-D] PYRIMIDINE AND THEIR USE AS ADENOSINE A2A RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2010-04-22 WO disclosed
WO-2010045015-A1 HETEROARYL SUBSTITUTED THIENO[2,3-D]PYRIMIDINE AND THEIR USE AS ADENOSINE A2A RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2010-04-22 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 (2 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-20190077762-A1 QUINOLONE COMPOUND HAX1, NQO2, NHERF1 S1PR4 4220/4885ALDH1A1 1466/4885KDM4E 3068/4885
US-10407619-B2 Liquid crystal composition RCC1, CCDC47, ACIN1 S1PR4 4499/4885ALDH1A1 4362/4885KDM4E 2427/4885

“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.