SCHEMBL12725115

SCHEMBL12725115

CN1C(=O)C2=C(c3cccs3)N(C)C(=O)C2=C1c1cccs1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKCA P17252 1/20 0.38
▸ GSK3B P49841 1/20 0.38
▸ KDM4E B2RXH2 5/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ CA12 O43570 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ ADORA1 P30542 1/20 0.37
▸ ERCC1 P07992 1/20 0.37
▸ FEN1 P39748 1/20 0.37
▸ ERCC4 Q92889 1/20 0.37
▸ DPP4 P27487 1/20 0.37
▸ TGFBR1 P36897 1/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL15932569 0.92 DPP4 (0.46) PRKCAGSK3BKDM4EALDH1A1DPP4
SCHEMBL15932566 0.92 DPP4 (0.46) PRKCAGSK3BKDM4EALDH1A1DPP4
SCHEMBL15932568 0.92 DPP4 (0.46) PRKCAGSK3BKDM4EALDH1A1DPP4
SCHEMBL12725123 0.88 DPP4 (0.50) PRKCAGSK3BKDM4EALDH1A1DPP4
SCHEMBL12725117 0.88 DPP4 (0.50) PRKCAGSK3BKDM4EALDH1A1DPP4
SCHEMBL12725187 0.87 LTA4H (0.44) GSK3BKDM4ETGFBR1LTA4H
SCHEMBL15249511 0.86 DPP4 (0.36) PRKCAGSK3BKDM4EALDH1A1CA12
SCHEMBL18386415 0.83 GSK3B (0.42) PRKCAGSK3BKDM4EALDH1A1CA12
SCHEMBL12725164 0.82 ALDH1A1 (0.40) PRKCAGSK3BKDM4EALDH1A1HSD17B10
SCHEMBL15969662 0.81 ALDH1A1 (0.34) KDM4EALDH1A1ADORA1ERCC1FEN1

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
WO-2023171740-A1 COMPOSITE LIGHT EMISSION SIGNAL GENERATION MATERIAL FOR STATE SENSING, LIGHT-EMITTING SUBSTANCE CARRIER, INK FOR STATE SENSING, MEASUREMENT CHIP, AND ANALYSIS METHOD コニカミノルタ株式会社 2023-09-14 — — WO disclosed
US-20230227475-A1 Asymmetric Fused Aromatic Ring Derivative Containing Sulfonyl Group, Use Thereof, Hydrogen Production Device and Optoelectronic Component NATIONAL TSING HUA UNIVERSITY (TW) 2023-07-20 — — US disclosed
CN-115304610-A Pyrrolo-pyrrole diketo red light conversion agent material 济南大学 2022-11-08 — — CN disclosed
WO-2019041047-A1 FLUORINATED DITHIENYL-DIKETOPYRROLOPYRROLE MONOMERS AND POLYMERS AND USES THEREOF UNIVERSITé LAVAL (CA) 2019-03-07 — — WO disclosed
US-9761803-B2 Semiconductor composition XEROX CORPORATION (US) 2017-09-12 — — US disclosed
US-20160133858-A1 Semiconducting Compounds and Devices Incorporating Same UNITED STATES DEPARTMENT OF ENERGY 2016-05-12 — — US disclosed
US-9214258-B2 Semiconductor composites comprising carbon nanotubes and diketopyrrolopyrrole-thiophene based copolymers XEROX CORPORATION (US) 2015-12-15 — — US disclosed
US-8754188-B2 Semiconducting compounds and devices incorporating same NORTHWESTERN UNIVERSITY (US) 2014-06-17 — — US disclosed
US-20140158946-A1 SEMICONDUCTOR COMPOSITES COMPRISING CARBON NANOTUBES AND DIKETOPYRROLOPYRROLE-THIOPHENE BASED COPOLYMERS XEROX CORPORATION (US) 2014-06-12 — — US disclosed
US-20130180589-A1 ORGANIC PHOTOVOLTAIC CELL MATERIALS AND COMPONENTS LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2013-07-18 — — US disclosed
US-20130180589-A1 ORGANIC PHOTOVOLTAIC CELL MATERIALS AND COMPONENTS LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2013-07-18 — — US disclosed
US-20130180589-A1 ORGANIC PHOTOVOLTAIC CELL MATERIALS AND COMPONENTS LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2013-07-18 — — US disclosed
US-8440785-B2 Compositions, methods and polymers PLEXTRONICS, INC. (US) 2013-05-14 — — US disclosed
US-20120264906-A1 SEMICONDUCTING COMPOUNDS AND DEVICES INCORPORATING SAME UNITED STATES DEPARTMENT OF ENERGY 2012-10-18 — — US disclosed
US-20120085992-A1 Furan Conjugated Polymers Useful for Photovoltaic Applications THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-04-12 — — US disclosed
US-7932344-B2 Diketopyrrolopyrrole-based polymers XEROX CORPORATION (US) 2011-04-26 — — US disclosed
US-7932344-B2 Diketopyrrolopyrrole-based polymers XEROX CORPORATION (US) 2011-04-26 — — US disclosed
US-7910684-B2 Diketopyrrolopyrrole-based derivatives for thin film transistors XEROX CORPORATION (US) 2011-03-22 — — US disclosed
US-20110028644-A1 NOVEL COMPOSITIONS, METHODS AND POLYMERS PLEXTRONICS, INC. 2011-02-03 — — US disclosed
US-20090065878-A1 DIKETOPYRROLOPYRROLE-BASED DERIVATIVES FOR THIN FILM TRANSISTORS XEROX CORPORATION 2009-03-12 — — 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 (4 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-20120264906-A1 SEMICONDUCTING COMPOUNDS AND DEVICES INCORPORATING SAME TST, NECTIN4, ICMT PRKCA 4559/4885GSK3B 3078/4885KDM4E 1249/4885
US-20160133858-A1 Semiconducting Compounds and Devices Incorporating Same TST, NECTIN4, ICMT PRKCA 4559/4885GSK3B 3078/4885KDM4E 1249/4885
US-20230227475-A1 Asymmetric Fused Aromatic Ring Derivative Containing Sulfonyl Group, Use Thereof, Hydrogen Production Device and Optoelectronic Component AHR, STS, HAT1 PRKCA 3144/4885GSK3B 3508/4885KDM4E 1870/4885
US-20130180589-A1 ORGANIC PHOTOVOLTAIC CELL MATERIALS AND COMPONENTS CCNT1, PKN2, CD4 PRKCA 1695/4885GSK3B 2936/4885KDM4E 2915/4885

“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.

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