SCHEMBL7202313

SCHEMBL7202313

C=CCN(CC=C)c1ccc(C(=S)c2ccc(N(CC=C)CC=C)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.40
CHKA P35790 1/20 0.40
CYP1A2 P05177 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
PTPN1 P18031 2/20 0.38
ALDH1A1 P00352 4/20 0.36
LMNA P02545 4/20 0.36
HPGD P15428 1/20 0.36
ALOX12 P18054 1/20 0.36
CCR6 P51684 1/20 0.36
KDM4E B2RXH2 3/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL851567 0.82 CHKA (0.50) GAACHKACYP1A2SMN1; SMN2PTPN1
SCHEMBL7854278 0.82 MEN1 (0.47) GAACHKACYP1A2SMN1; SMN2PTPN1
SCHEMBL88637 0.80 HPGD (0.52) CHKASMN1; SMN2PTPN1ALDH1A1LMNA
SCHEMBL609106 0.78 SMN1; SMN2 (0.40) GAACHKASMN1; SMN2PTPN1ALDH1A1
SCHEMBL250420 0.78 TSHR (0.46) CHKASMN1; SMN2PTPN1ALDH1A1HTT
SCHEMBL4564604 0.77 MAPT (0.50) GAASMN1; SMN2PTPN1ALDH1A1LMNA
SCHEMBL5950655 0.77 KDM4E (0.47) GAACHKASMN1; SMN2PTPN1ALDH1A1
SCHEMBL1018958 0.77 ESR1 (0.45) GAACHKACYP1A2PTPN1ALDH1A1
SCHEMBL7162904 0.76 CHKA (0.46) GAACHKACYP1A2SMN1; SMN2PTPN1
SCHEMBL6466250 0.76 CHKA (0.46) GAACHKACYP1A2SMN1; SMN2PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8053485-A None JP disclosed
EP-3679343-B1 COUPON DESIGN FOR ENHANCED COLOR SENSITIVITY FOR COLORIMETRIC-BASED CHEMICAL ANALYSIS OF LIQUIDS UNIV CLEMSON RES FOUNDATION (US) 2023-06-07 EP disclosed
US-20210364444-A1 Coupon Design for Enhanced Color Sensitivity for Colorimetric-Based Chemical Analysis of Liquids UNIV CLEMSON RES FOUNDATION (US) 2021-11-25 US disclosed
EP-3679343-A1 COUPON DESIGN FOR ENHANCED COLOR SENSITIVITY FOR COLORIMETRIC-BASED CHEMICAL ANALYSIS OF LIQUIDS Clemson University Research Foundation (US) 2020-07-15 EP disclosed
WO-2019050837-A1 COUPON DESIGN FOR ENHANCED COLOR SENSITIVITY FOR COLORIMETRIC-BASED CHEMICAL ANALYSIS OF LIQUIDS CLEMSON UNIVERSITY RESEARCH FOUNDATION (US) 2019-03-14 WO disclosed
US-6541269-B1 Colorimetric test strips INDUSTRIAL TEST SYSTEMS, INC. 2003-04-01 US disclosed
JP-H0853485-A METHOD FOR SELECTIVELY ACETALIZING SACCHARIDES AGENCY OF IND SCIENCE & TECHNOL 1996-02-27 JP disclosed
US-4459192-A CONTAINING ETHYLENICALLY UNSATURATED MONOMERS AND BENZOIN ETHER PHOTOINITIATOR STAUFFER CHEMICAL COMPANY (US) 1984-07-10 US disclosed
US-4260465-A Photopolymerizable composition stabilized with epoxide compounds and process STAUFFER CHEMICAL COMPANY (US) 1981-04-07 US disclosed
US-4146453-A GELATION INHIBITION STAUFFER CHEMICAL COMPANY (US) 1979-03-27 US disclosed