SCHEMBL7359692

SCHEMBL7359692

CC1(CN)CNc2[nH]c(N)nc(=O)c2N1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.31

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
SCHEMBL7359688 0.77 NOS1 (0.48) NOS1
SCHEMBL19235750 0.69
SCHEMBL3454166 0.68 PNP (0.32) NOS1
SCHEMBL2273420 0.67
SCHEMBL16554109 0.67
SCHEMBL584983 0.64 NOS1 (0.36) NOS1
Hydrochloric Acid SCHEMBL16741182 0.63 KDM4E (0.36) NOS1
SCHEMBL2044798 0.61 NOS1 (0.49) NOS1
SCHEMBL18520768 0.60 NOS1 (0.46) NOS1
Hydrochloric Acid SCHEMBL28835504 0.60 KDM4E (0.33) NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5401844-A Chemical intermediates for treatment of parkinson*s disease SOUTH ALABAMA MEDICAL SCIENCE FOUNDATION (US) 1995-03-28 US disclosed
US-5196533-A Treatment of Parkinson*s disease, inhibitor of thymidylate synthetase SOUTH ALABAMA MEDICAL SCIENCE FOUNDATION, USA (US) 1993-03-23 US disclosed
EP-0138995-B1 REGULATION OF ENZYMES WHICH UTILIZE TETRAHYDROBIOPTERIN OR TETRAHYDROFOLATE COFACTORS WITH 6, 6-DISUBSTITUTED-TETRAHYDROPTERIDINES South Alabama Medical Science Foundation (US) 1991-08-14 EP disclosed
EP-0138995-A4 REGULATION OF ENZYMES WHICH UTILIZE TETRAHYDROBIOPTERIN OR TETRAHYDROFOLATE COFACTORS WITH 6, 6-DISUBSTITUTED-TETRAHYDROPTERIDINES. UNIV SOUTH ALABAMA (US) 1988-05-10 EP disclosed
EP-0138995-A1 REGULATION OF ENZYMES WHICH UTILIZE TETRAHYDROBIOPTERIN OR TETRAHYDROFOLATE COFACTORS WITH 6, 6-DISUBSTITUTED-TETRAHYDROPTERIDINES. UNIV SOUTH ALABAMA (US) 1985-05-02 EP disclosed
WO-1984004040-A1 REGULATION OF ENZYMES WHICH UTILIZE TETRAHYDROBIOPTERIN OR TETRAHYDROFOLATE COFACTORS WITH 6, 6-DISUBSTITUTED-TETRAHYDROPTERIDINES UNIV SOUTH ALABAMA (US) 1984-10-25 WO disclosed