SCHEMBL9853259

SCHEMBL9853259

CNCCN1CCN(c2ccccc2C2CC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 14/20 0.55
PRMT6 Q96LA8 14/20 0.55
HTR1A P08908 1/20 0.52
ADRA1B P35368 1/20 0.52
SIGMAR1 Q99720 2/20 0.47
TMEM97 Q5BJF2 1/20 0.46
PRMT8 Q9NR22 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46

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
Hydrochloric Acid SCHEMBL9739959 0.99 CARM1 (0.54) CARM1PRMT6HTR1AADRA1BSIGMAR1
SCHEMBL8297825 0.92 HTR1A (0.50) CARM1PRMT6HTR1AADRA1BSIGMAR1
Hydrochloric Acid SCHEMBL9134644 0.91 HTR1A (0.49) CARM1PRMT6HTR1AADRA1BSIGMAR1
SCHEMBL4855424 0.84 CARM1 (0.45) CARM1PRMT6HTR1AADRA1BSIGMAR1
Hydrochloric Acid SCHEMBL5015868 0.83 CARM1 (0.44) CARM1PRMT6HTR1AADRA1BSIGMAR1
SCHEMBL27433853 0.79 HTR1A (0.48) HTR1AADRA1BSIGMAR1
SCHEMBL8828503 0.78 CYP2D6 (0.56) HTR1AADRA1BSIGMAR1
SCHEMBL23064518 0.78 ADRA2C (0.55) HTR1AADRA1B
Hydrochloric Acid SCHEMBL4859668 0.77 DRD2 (0.54) HTR1AADRA1BSIGMAR1
Hydrochloric Acid SCHEMBL4856751 0.76 DRD2 (0.47) HTR1AADRA1B

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-0435749-A1 Derivatives of 2-aminopyrimidine-4-carboxamide, their preparation and therapeutic use SYNTHELABO (FR) 1991-07-03 EP disclosed