SCHEMBL178966

SCHEMBL178966

O=C1NC(c2cc3ccccc3s2)=C2C(=O)NC(c3cc4ccccc4s3)=C12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.45
CA9 Q16790 4/20 0.43
CA1 P00915 3/20 0.43
CA12 O43570 3/20 0.43
GSK3B P49841 1/20 0.43
CA2 P00918 3/20 0.43
CYP2A6 P11509 1/20 0.41
HSD17B1 P14061 1/20 0.41
HSD17B2 P37059 1/20 0.41
PTGS2 P35354 2/20 0.40
ERN1 O75460 2/20 0.40
CA4 P22748 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
PTGS1 P23219 1/20 0.40
BRD4 O60885 1/20 0.40
CREBBP Q92793 1/20 0.40
NQO1 P15559 1/20 0.40

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
SCHEMBL18257893 0.91 APP (0.41) APPCA9CA1CA12GSK3B
SCHEMBL29732980 0.74 APP (0.63) APPCA9CA1CA12CA2
SCHEMBL845603 0.74 APP (0.63) APPCA9CA1CA12CA2
SCHEMBL2150464 0.73 APP (0.57) APPCA9CA1CA12CA2
SCHEMBL178974 0.72 GPR35 (0.40)
SCHEMBL12264654 0.71 CYP2A6 (0.33) CYP2A6
SCHEMBL3046995 0.71 BRD4 (0.47) APPCA9CA1CA12GSK3B
SCHEMBL2149612 0.71 APP (0.59) APPCA9CA1CA12CA2
SCHEMBL19133572 0.69 APP (0.57) APPCA9CA1CA2CYP2A6
SCHEMBL32677328 0.69 APP (0.81) APPCA9CA1CA2CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2621927-B1 SEMICONDUCTORS BASED ON DIKETOPYRROLOPYRROLES BASF SE (DE) 2020-02-12 EP disclosed
EP-2435500-B1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2019-10-30 EP disclosed
US-10177313-B2 Diketopyrrolopyrrole polymers for use in organic semiconductor devices BASF SE (DE) 2019-01-08 US disclosed
US-20170005270-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES CLAP CO., LTD. (KR) 2017-01-05 US disclosed
US-9478745-B2 Diketopyrrolopyrrole polymers for use in organic semiconductor devices BASF SE (DE) 2016-10-25 US disclosed
EP-2411986-B1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2016-09-21 EP disclosed
US-8946376-B2 Semiconductors based on diketopyrrolopyrroles BASF SE (DE) 2015-02-03 US disclosed
US-20140303335-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES 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
WO-2012041849-A1 SEMICONDUCTORS BASED ON DIKETOPYRROLOPYRROLES BASF SE (DE) 2012-04-05 WO disclosed
US-20120074393-A1 SEMICONDUCTORS BASED ON DIKETOPYRROLOPYRROLES BASF SE (DE) 2012-03-29 US disclosed
US-20120071617-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2012-03-22 US disclosed
US-20120059140-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2012-03-08 US disclosed
US-20110317628-A1 METHOD OF PERFORMING WIRELESS COMMUNICATION IN MULTI-CARRIER SYSTEM LG ELECTRONICS INC. (KR) 2011-12-29 US disclosed
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
WO-2010136353-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2010-12-02 WO disclosed
WO-2010108873-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2010-09-30 WO disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 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-20120074393-A1 SEMICONDUCTORS BASED ON DIKETOPYRROLOPYRROLES PDK1, CD2, DDT APP 3015/4885CA9 2139/4885CA1 1956/4885
US-20120059140-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES MARK1, SKP1, AK1 APP 2547/4885CA9 4656/4885CA1 4396/4885
US-10177313-B2 Diketopyrrolopyrrole polymers for use in organic semiconductor devices MARK1, SKP1, AK1 APP 2547/4885CA9 4656/4885CA1 4396/4885

“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.