SCHEMBL20037637

SCHEMBL20037637

CNc1ccc(OC2CNC2)nn1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 5/20 0.37
SLC6A3 Q01959 5/20 0.37
SLC6A4 P31645 4/20 0.37
CSF1R P07333 1/20 0.35
HTR1A P08908 2/20 0.33
GLS O94925 1/20 0.32
AXL P30530 1/20 0.32
MERTK Q12866 1/20 0.32
CHRM1 P11229 1/20 0.31
CDK4 P11802 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
SCHEMBL22663453 0.84 CSF1R (0.41) CSF1RGLSAXLMERTKCDK4
SCHEMBL20037642 0.80 SLC6A2 (0.32) SLC6A2SLC6A3SLC6A4
SCHEMBL23768327 0.75 LRRK2 (0.37) CSF1R
SCHEMBL18291279 0.73 SLC6A4 (0.37) SLC6A2SLC6A3SLC6A4
SCHEMBL20249274 0.73 SLC6A2 (0.37) SLC6A2SLC6A3SLC6A4HTR1ACHRM1
SCHEMBL31240205 0.72 LMNA (0.46)
SCHEMBL3113252 0.72 LMNA (0.46)
Hydrochloric Acid SCHEMBL28513109 0.70 LMNA (0.45)
SCHEMBL31532572 0.70 SLC6A4 (0.38) SLC6A2SLC6A3SLC6A4HTR1A
SCHEMBL28680550 0.68 CHRNB2 (0.46) SLC6A2HTR1ACHRM1

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-3305785-A1 PYRIDO[3,4-d]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Teijin Pharma Limited (JP) 2018-04-11 EP disclosed