SCHEMBL9537190

SCHEMBL9537190

NCCN1CCC(Cc2nc3ncccc3n2Cc2ccc(F)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRMT3 O60678 1/20 0.44
CARM1 Q86X55 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
PRMT1 Q99873 1/20 0.44
PRMT8 Q9NR22 1/20 0.44
SLC6A9 P48067 1/20 0.43
GRM2 Q14416 1/20 0.42
SSTR5 P35346 1/20 0.41
CYP2D6 P10635 2/20 0.40
HRH1 P35367 2/20 0.40
KCNH2 Q12809 1/20 0.40
CHRM1 P11229 1/20 0.40

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
SCHEMBL9536547 0.88 SSTR5 (0.52) SSTR5
SCHEMBL9537882 0.87 SLC6A9 (0.41) SLC6A9GRM2SSTR5CYP2D6HRH1
SCHEMBL9536663 0.86 RAB9A (0.55) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL9537085 0.85 SLC6A9 (0.58) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL9537962 0.84 HTR1A (0.57) SSTR5CYP2D6HRH1KCNH2CHRM1
SCHEMBL10804293 0.83 KCNH2 (0.47) SLC6A9GRM2CYP2D6HRH1KCNH2
SCHEMBL9536078 0.82 KCNH2 (0.50) CYP2D6HRH1KCNH2CHRM1
Oxalic Acid SCHEMBL10802671 0.82 GRIN2B (0.41) SLC6A9SSTR5
Oxalic Acid SCHEMBL9538513 0.82 GRIN2B (0.41) SLC6A9SSTR5
Oxalic Acid SCHEMBL9538518 0.82 GRIN2B (0.41) SLC6A9SSTR5

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
EP-0151826-B1 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines JANSSEN PHARMACEUTICA N.V. (BE) 1993-03-31 EP disclosed
US-4839374-A TREATING ALLERGIES JANSSEN PHARMACEUTICA, N.V. (BE) 1989-06-13 US disclosed
US-4695575-A ANTIHISTAMINES JANSSEN PHARMACEUTICA, N.V. (BE) 1987-09-22 US disclosed
EP-0151826-A1 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines JANSSEN PHARMACEUTICA N.V. (BE) 1985-08-21 EP disclosed