SCHEMBL9567690

SCHEMBL9567690

Nc1c[nH]nn1.O=C(O)c1c[nH]nn1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.31
KDM4E B2RXH2 2/20 0.30
ALOX15 P16050 1/20 0.30
ACMSD Q8TDX5 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
KDM5A P29375 1/20 0.30
JMJD1C Q15652 1/20 0.30
KDM3A Q9Y4C1 1/20 0.30

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
Hydrazine SCHEMBL27364551 0.88 KDM4E (0.34) TSHRKDM4EALOX15ACMSDTDP1
SCHEMBL52479 0.88
SCHEMBL8404927 0.87
Hydrochloric Acid SCHEMBL9597717 0.86
Ammonia Solution, Strong SCHEMBL28124824 0.86
SCHEMBL28905564 0.86
SCHEMBL30149273 0.86 KDM4E (0.36) TSHRKDM4EALOX15ACMSDTDP1
Arsenic SCHEMBL27823540 0.86
Carbamic Acid SCHEMBL28626036 0.84 ACHE (0.32) TSHR
Lithium Ion SCHEMBL30424549 0.84 KDM4E (0.34) TSHRKDM4EALOX15ACMSDTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0543465-A2 Chemical compounds with spin transition and use of these for information storing, processing and/or data display LABORATOIRES D'ELECTRONIQUE PHILIPS S.A.S. (FR) 1993-05-26 EP disclosed