SCHEMBL120524

SCHEMBL120524

CCCCCCc1csc(B(C)O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 7/20 0.45
LPL P06858 6/20 0.45
TRPV1 Q8NER1 1/20 0.45
MGLL Q99685 1/20 0.45
PTGS2 P35354 4/20 0.44
CYP3A4 P08684 2/20 0.42
ESR1 P03372 2/20 0.41
ADRA2A P08913 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
TACR2 P21452 2/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
SHBG P04278 1/20 0.41
TP53 P04637 1/20 0.41
HSPD1 P10809 1/20 0.41
ADRB3 P13945 1/20 0.41

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
SCHEMBL14586048 0.88 LIPG (0.50) LIPGLPLTRPV1MGLLPTGS2
SCHEMBL793134 0.88 LIPG (0.50) LIPGLPLTRPV1MGLLPTGS2
SCHEMBL5030712 0.80 PTGS2 (0.41) LIPGLPLTRPV1MGLLPTGS2
SCHEMBL15672939 0.76 LPL (0.36) LIPGLPLTRPV1MGLLPTGS2
SCHEMBL28937354 0.75 PTGS2 (0.55) LIPGLPLPTGS2CYP3A4ESR1
SCHEMBL1323842 0.74 PTGS2 (0.48) LIPGLPLTRPV1MGLLPTGS2
SCHEMBL2012315 0.74 PTGS2 (0.48) LIPGLPLTRPV1MGLLPTGS2
SCHEMBL196514 0.74 PTGS2 (0.48) LIPGLPLTRPV1MGLLPTGS2
SCHEMBL3555634 0.74 PTGS2 (0.48) LIPGLPLTRPV1MGLLPTGS2
SCHEMBL2607172 0.73 PTGS2 (0.47) LIPGLPLTRPV1MGLLPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9748487-B2 Polymers based on naphthodiones BASF SE (DE) 2017-08-29 US disclosed
US-20170005270-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES CLAP CO., LTD. (KR) 2017-01-05 US disclosed
US-9505877-B2 Phenanthro[9,10-B]furan polymers and small molecules for electronic applications BASF SE (DE) 2016-11-29 US disclosed
US-9359470-B2 Dithienobenzofuran polymers and small molecules for electronic application BASF SE (DE) 2016-06-07 US disclosed
US-9276215-B2 Diketopyrrolopyrrole polymers for use in organic semiconductor devices BASF SE (DE) 2016-03-01 US disclosed
US-20160049588-A1 POLYMERS BASED ON NAPHTHODIONES BASF SE (DE) 2016-02-18 US disclosed
US-9240551-B2 Polymers based on benzodiones BASF SE (DE) 2016-01-19 US disclosed
US-9074050-B2 Process for the production of polymers by using coupling reactions BASF SE (DE) 2015-07-07 US disclosed
US-20150132887-A1 DITHIENOBENZOFURAN POLYMERS AND SMALL MOLECULES FOR ELECTRONIC APPLICATION BASF SE (DE) 2015-05-14 US disclosed
US-20150111337-A1 PHENANTHRO[9,10-B]FURAN POLYMERS AND SMALL MOLECULES FOR ELECTRONIC APPLICATIONS BASF SE (DE) 2015-04-23 US disclosed
US-8975359-B2 Diketopyrrolopyrrole polymers for use in organic semiconductor devices BASF SE (DE) 2015-03-10 US disclosed
US-20140332730-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2014-11-13 US disclosed
US-20140302637-A1 POLYMERS BASED ON BENZODIONES BASF SE (DE) 2014-10-09 US disclosed
US-8796469-B2 Diketopyrrolopyrrole polymers for use in organic semiconductor devices BASF SE (DE) 2014-08-05 US disclosed
US-20140080994-A1 PROCESS FOR THE PRODUCTION OF POLYMERS BY USING COUPLING REACTIONS BASF SE (DE) 2014-03-20 US disclosed
US-20130306151-A1 ORGANIC PHOTOVOLTAIC DEVICE AND MANUFACTURING METHOD THEREOF BASF SE (DE) 2013-11-21 US disclosed
US-20120142872-A1 PROCESS FOR POLYMERISING (HETERO)AROMATIC COMPOUNDS BASF SE (DE) 2012-06-07 US disclosed
US-20120059140-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2012-03-08 US disclosed
US-20110215313-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2011-09-08 US 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-20160049588-A1 POLYMERS BASED ON NAPHTHODIONES CCND2, CCND1, PCNA LIPG 4566/4885LPL 4371/4885TRPV1 1676/4885
US-20120059140-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES MARK1, SKP1, AK1 LIPG 4848/4885LPL 4712/4885TRPV1 157/4885
US-20150132887-A1 DITHIENOBENZOFURAN POLYMERS AND SMALL MOLECULES FOR ELECTRONIC APPLICATION DDT, F12, ETFB LIPG 3570/4885LPL 4687/4885TRPV1 886/4885

“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.