SCHEMBL3363042

SCHEMBL3363042

CNCc1cccc(CN)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 6/20 0.53
CYP3A4 P08684 2/20 0.52
KDM4E B2RXH2 1/20 0.52
MAPT P10636 1/20 0.52
PRMT6 Q96LA8 7/20 0.50
PNMT P11086 1/20 0.48
ENPP2 Q13822 1/20 0.48
LOXL2 Q9Y4K0 2/20 0.48
EPHX2 P34913 1/20 0.47
NOS3 P29474 4/20 0.47
NOS2 P35228 3/20 0.47
ALDH1A1 P00352 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NFKB1 P19838 1/20 0.47
HTR7 P34969 1/20 0.45

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
SCHEMBL30125422 1.00 NOS1 (0.53) NOS1CYP3A4KDM4EMAPTPRMT6
SCHEMBL22181074 0.94 CYP3A4 (0.61) NOS1CYP3A4KDM4EMAPTPRMT6
SCHEMBL8986195 0.90 PRMT6 (0.64) NOS1CYP3A4KDM4EMAPTPRMT6
SCHEMBL1697126 0.89 MAPT (0.64) NOS1CYP3A4KDM4EMAPTPRMT6
Hydrochloric Acid SCHEMBL3273205 0.86 MAPT (0.68) NOS1CYP3A4KDM4EMAPTPRMT6
N-Benzylmethylamine SCHEMBL8215110 0.84 CYP3A4 (0.74) NOS1CYP3A4KDM4EMAPTPRMT6
Water SCHEMBL28545356 0.83 LOXL2 (0.67) NOS1CYP3A4PRMT6PNMTENPP2
N-Benzylmethylamine SCHEMBL607789 0.83 MAPT (0.78) NOS1CYP3A4KDM4EMAPTPRMT6
SCHEMBL30186883 0.82 LOXL2 (0.52) NOS1CYP3A4PRMT6PNMTENPP2
SCHEMBL834002 0.82 LOXL2 (0.52) NOS1CYP3A4PRMT6PNMTENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2796443-B1 Curing agent for low temperature cure applications EVONIK DEGUSSA GMBH (DE) 2018-07-04 EP claimed
EP-2159218-B1 Curing agent for low temperature cure applications EVONIK DEGUSSA GMBH (DE) 2018-06-06 EP claimed
CN-104974333-A Curing Agent For Low Temperature Cure Applications AIR PROD & CHEM 2015-10-14 CN claimed
US-8512594-B2 Curing agent of N,N′-dimethyl-meta-xylylenediamine and multifunctional amin(s) AIR PRODUCTS AND CHEMICALS, INC. (US) 2013-08-20 US claimed
CN-101781397-A Curing agents for low temperature curing applications AIR PROD & CHEM 2010-07-21 CN claimed
EP-2159218-A1 Curing agent for low temperature cure applications Air Products and Chemicals, Inc. (US) 2010-03-03 EP claimed
US-20100048827-A1 CURING AGENT FOR LOW TEMPERATURE CURE APPLICATIONS AIR PRODUCTS AND CHEMICALS, INC. (US) 2010-02-25 US claimed
EP-3642287-B1 AQUEOUS DISPERSION OF POLYMERIC CAPSULES AGFA GEVAERT NV (BE) 2023-09-06 EP disclosed
US-11530226-B2 Azepane inhibitors of menin-MLL interaction JANSSEN PHARMACEUTICA NV (BE) 2022-12-20 US disclosed
WO-2022118186-A1 SENOTHERAPEUTIC COMPOUND BIONEXA S.R.L. (IT) 2022-06-09 WO disclosed
US-20220073699-A1 OXYGEN SCAVENGERS, COMPOSITIONS COMPRISING THE SCAVENGERS, AND ARTICLES MADE FROM THE COMPOSITIONS WELLS FARGO BANK, N.A., AS ADMINISTRATIVE AGENT 2022-03-10 US disclosed
US-11124593-B2 Modified block copolymer, method for producing modified block copolymer, and resin composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2021-09-21 US disclosed
US-20210230352-A1 METHOD FOR MANUFACTURING DIISOCYANATE AND OPTICAL LENS WOORI FINE CHEM CO., LTD. (KR) 2021-07-29 US disclosed
US-20070043095-A1 Derivatives of 2-arylimino-2,3-dihydrothiazoles, their preparation processes and their therapeutic use IPSEN PHARMA S.A.S. (FR) 2007-02-22 US disclosed
US-20060039861-A1 Peptide-based multimeric targeted contrast agents EPIX MEDICAL, INC., A DELAWARE CORPORATION 2006-02-23 US disclosed
US-20050074411-A1 Peptide-based multimeric targeted contrast agents EPIX MEDICAL, INC. A DELAWARE CORPORATION 2005-04-07 US disclosed
EP-0558048-B1 Thermoplastic resin composition IDEMITSU PETROCHEMICAL CO (JP) 1999-07-07 EP disclosed
EP-0558047-B1 Copolymer having amino group and process for production thereof DAI ICHI KOGYO SEIYAKU CO LTD (JP) 1998-05-20 EP disclosed
US-5552480-A BLEND, IMIDIZED ADDITION POLYMER, ENGINEERING PLASTIC, IMPACT STRENGTH IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1996-09-03 US disclosed
EP-0558048-A1 Thermoplastic resin composition IDEMITSU PETROCHEMICAL COMPANY LIMITED (JP) 1993-09-01 EP 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 (6 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-20060039861-A1 Peptide-based multimeric targeted contrast agents NGLY1, IAPP, NPPA NOS1 4334/4885CYP3A4 4876/4885KDM4E 4774/4885
US-20210230352-A1 METHOD FOR MANUFACTURING DIISOCYANATE AND OPTICAL LENS SMO, CRYAA, INCENP NOS1 561/4885CYP3A4 2523/4885KDM4E 2653/4885
US-20050074411-A1 Peptide-based multimeric targeted contrast agents NGLY1, IAPP, NPPA NOS1 4334/4885CYP3A4 4876/4885KDM4E 4774/4885
US-20070043095-A1 Derivatives of 2-arylimino-2,3-dihydrothiazoles, their preparation processes and their therapeutic use SSTR2, SSTR5, SSTR3 NOS1 3032/4885CYP3A4 973/4885KDM4E 4074/4885
US-11530226-B2 Azepane inhibitors of menin-MLL interaction MEN1, MLLT1, BMI1 NOS1 4550/4885CYP3A4 4491/4885KDM4E 132/4885
US-20220073699-A1 OXYGEN SCAVENGERS, COMPOSITIONS COMPRISING THE SCAVENGERS, AND ARTICLES MADE FROM THE COMPOSITIONS PRDX5, LPO, CAT NOS1 63/4885CYP3A4 2498/4885KDM4E 4201/4885

“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.