SCHEMBL3752264

SCHEMBL3752264

N=C(N)c1cccc2c1ccn2O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.33
F2 P00734 2/20 0.31
PRSS1 P07477 1/20 0.31
PLAU P00749 2/20 0.30
F12 P00748 1/20 0.30
F7 P08709 1/20 0.30
F3 P13726 1/20 0.30
PKM P14618 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
SCHEMBL1794843 0.81 KDM4E (0.44)
Hydrochloric Acid SCHEMBL23754646 0.79 TUBB4A (0.45)
SCHEMBL28013758 0.76 KDM4E (0.39) F10F2PRSS1F12F7
SCHEMBL2124455 0.75
SCHEMBL4954396 0.72 ALDH1A1 (0.44) F2PRSS1PLAU
SCHEMBL4956866 0.70 HTR2C (0.47) PLAU
SCHEMBL16897117 0.68 PARP1 (0.33)
SCHEMBL18225474 0.68 PARP1 (0.34) F10F2
SCHEMBL29393451 0.67 NR4A1 (0.56) F2PRSS1PLAU
SCHEMBL49654 0.67 NR4A1 (0.56) F2PRSS1PLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110255694-A A kind of method of artificial synthesized redox mediators activation potassium permanganate degradation organic pollutants 重庆大学 2019-09-20 CN disclosed
CN-102118972-B Novel modulators of sphingosine phosphate receptors SCRIPPS RESEARCH INST 2015-06-10 CN disclosed
CN-102118972-A Novel modulators of sphingosine phosphate receptors SCRIPPS RESEARCH INST 2011-07-06 CN disclosed
US-7834039-B2 Oxadiazole compounds ABBOTT LABORATORIES (US) 2010-11-16 US disclosed