SCHEMBL2385337

SCHEMBL2385337

NC(=O)c1cnc(N)nc1N

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 1/20 0.43
P2RX2 Q9UBL9 1/20 0.43
IKBKB O14920 1/20 0.43
PDPK1 O15530 1/20 0.42
HSP90AA1 P07900 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
CDC7 O00311 3/20 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
SCHEMBL8625804 0.83 GABRP (0.46) P2RX3P2RX2HSP90AA1KDM4EALDH1A1
SCHEMBL27415510 0.81 HSP90AA1 (0.41) P2RX3P2RX2HSP90AA1KDM4E
SCHEMBL14757636 0.81 NNMT (0.46) P2RX3P2RX2HSP90AA1KDM4EHPGD
SCHEMBL16649308 0.81 HSP90AA1 (0.38) P2RX3P2RX2HSP90AA1KDM4EALDH1A1
SCHEMBL14619795 0.79 IKBKB (0.41) IKBKBKDM4EALDH1A1GLAGAA
SCHEMBL584137 0.79 NNMT (0.43) IKBKBKDM4EALDH1A1GLAGAA
SCHEMBL16120968 0.79 CSNK1A1 (0.44) IKBKBKDM4EALDH1A1GLAGAA
SCHEMBL11255807 0.78 DHFR (0.33)
SCHEMBL30468126 0.76 TSHR (0.47) HSP90AA1KDM4EALDH1A1GLAGAA
SCHEMBL6527376 0.76 MAPK8 (0.42) IKBKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105753798-A Novel gas production compound 北京理工大学 2016-07-13 CN claimed
EP-4655302-A1 TYRO3 SELECTIVE INHIBITORS AND USES THEREOF The University of North Carolina at Chapel Hill (US) 2025-12-03 EP disclosed
WO-2024159097-A1 TYRO3 SELECTIVE INHIBITORS AND USES THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2024-08-02 WO disclosed
EP-3600440-A1 REDUCED EXPOSURE CONJUGATES MODULATING THERAPEUTIC TARGETS Sienna Biopharmaceuticals, Inc. (US) 2020-02-05 EP disclosed
WO-2020023389-A1 REDUCED EXPOSURE COMPOSITIONS MODULATING THERAPEUTIC TARGETS SIENNA BIOPHARMACEUTICALS, INC. (US) 2020-01-30 WO disclosed
WO-2019057112-A1 2-SUBSTITUTED PYRAZOLE AMINO-4-SUBSTITUTED AMINO-5-PYRIMIDINE FORMAMIDE COMPOUND, COMPOSITION, AND APPLICATION THEREOF 北京赛特明强医药科技有限公司 2019-03-28 WO disclosed
WO-2018175340-A1 REDUCED EXPOSURE CONJUGATES MODULATING THERAPEUTIC TARGETS SIENNA BIOPHARMACEUTICALS, INC. (US) 2018-09-27 WO disclosed
WO-2018175315-A1 POLYMER CONJUGATES OF STAUROSPORINE DERIVATIVES HAVING REDUCED EXPOSURE SIENNA BIOPHARMACEUTICALS, INC. (US) 2018-09-27 WO disclosed
CN-105753798-A Novel gas production compound 北京理工大学 2016-07-13 CN disclosed
CN-105753798-A Novel gas production compound 北京理工大学 2016-07-13 CN disclosed
CN-102066339-A 2, 6-diamino-pyrimidin-5-yl-carboxamides as SYK or JAK protein kinase inhibitors PORTOLA PHARM INC 2011-05-18 CN disclosed
CN-102066340-A 2, 6-diamino-pyrimidin- 5-yl-carboxamides as SRK or JAK kinases inhibitors PORTOLA PHARM INC 2011-05-18 CN disclosed
JP-2010174027-A DIAMINOPYRIMIDINE CARBOXAMIDE DERIVATIVE ASTELLAS PHARMA INC 2010-08-12 JP disclosed
US-20090281072-A1 Diaminopyrimidinecarboxamide Derivative ASTELLAS PHARM INC. (JP) 2009-11-12 US disclosed
US-7449456-B2 Diaminopyrimidinecarboxamide derivative ASTELLAS PHARMA, INC. (JP) 2008-11-11 US disclosed
US-20050272753-A1 Diaminopyrimidinecarboxa mide derivative ASTELLAS PHARMA INC. (JP) 2005-12-08 US disclosed
CN-1665789-A Diaminopyrimidinecarboxa mide derivative YAMANOUCHI PHARMA CO LTD (JP) 2005-09-07 CN disclosed
EP-1518855-A1 DIAMINOPYRIMIDINECARBOXA MIDE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2005-03-30 EP disclosed
US-RE31136-E Herbicidal 5-pyrimidinecarbonitriles FMC CORPORATION (US) 1983-02-01 US disclosed
US-4092150-A Herbicidal 5-pyrimidinecarbonitriles FMC CORPORATION (US) 1978-05-30 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 (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-20050272753-A1 Diaminopyrimidinecarboxa mide derivative STAT5A, STAT6, STAT4 P2RX3 3278/4885P2RX2 3799/4885IKBKB 95/4885
US-20090281072-A1 Diaminopyrimidinecarboxamide Derivative STAT6, STAT4, STAT3 P2RX3 2969/4885P2RX2 3201/4885IKBKB 43/4885

“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.