SCHEMBL7407267

SCHEMBL7407267

c1ccc2c3c([nH]c2c1)CCC(N1CCCC1)C3

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR2E1 Q9Y466 1/20 0.58
HTR1D P28221 2/20 0.51
CHRNA7 P36544 1/20 0.48
RB1 P06400 1/20 0.46
ADRA1D P25100 1/20 0.46
ADRA1A P35348 1/20 0.46
ADRA1B P35368 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
SCHEMBL7412946 0.99 NR2E1 (0.57) NR2E1HTR1DCHRNA7RB1
SCHEMBL25424716 0.90 NR2E1 (0.54) NR2E1CHRNA7RB1ADRA1DADRA1A
SCHEMBL25424582 0.90 NR2E1 (0.54) NR2E1CHRNA7RB1ADRA1DADRA1A
SCHEMBL25423066 0.90 NR2E1 (0.54) NR2E1CHRNA7RB1ADRA1DADRA1A
SCHEMBL7409548 0.89 NR2E1 (0.56) NR2E1CHRNA7
SCHEMBL7409746 0.88 NR2E1 (0.55) NR2E1CHRNA7ADRA1DADRA1AADRA1B
SCHEMBL7412841 0.88 NR2E1 (0.55) NR2E1CHRNA7ADRA1DADRA1AADRA1B
SCHEMBL7412109 0.88 NR2E1 (0.55) NR2E1CHRNA7ADRA1DADRA1AADRA1B
SCHEMBL7408311 0.85 HTR7 (0.53) NR2E1CHRNA7
SCHEMBL12244114 0.83 KDM4E (0.48) NR2E1ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4172834-A ANALGESICS, ANTIHISTAMINES AND PSYCHOTROPIC AGENTS STERLING DRUG INC. (US) 1979-10-30 US claimed
US-4257952-A PSYCHOTROPIC DRUGS, ANALGESICS, ANTIHISTAMINES STERLING DRUG INC. (US) 1981-03-24 US disclosed
US-4172834-A ANALGESICS, ANTIHISTAMINES AND PSYCHOTROPIC AGENTS STERLING DRUG INC. (US) 1979-10-30 US disclosed
US-4062864-A ANALGESIC, PSYCHOTROPIC, ANTIHISTAMINE STERLING DRUG INC. (US) 1977-12-13 US disclosed
US-3959309-A ANALGESICS, PSYCHOTROPIC, ANTIHISTAMINE STERLING DRUG INC. (US) 1976-05-25 US disclosed