SCHEMBL7412987

SCHEMBL7412987

Cc1cccc(C)c1N1CCN(CCNC2CCc3[nH]c4ccccc4c3C2)CC1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RB1 P06400 5/20 0.47
VCP P55072 5/20 0.46
NR2E1 Q9Y466 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
CHRNA7 P36544 1/20 0.39

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
SCHEMBL7409212 0.87 RB1 (0.51) RB1VCPNR2E1CHRNA7
SCHEMBL7409934 0.86 RB1 (0.51) RB1VCPNR2E1
SCHEMBL7417660 0.85 RB1 (0.53) RB1VCPNR2E1CHRNA7
SCHEMBL7409560 0.84 VCP (0.54) RB1VCP
SCHEMBL7411272 0.84 RB1 (0.52) RB1VCPNR2E1
SCHEMBL7410027 0.83 VCP (0.50) RB1VCPNR2E1
SCHEMBL7405425 0.83 RB1 (0.51) RB1VCPNR2E1CHRNA7
SCHEMBL7410031 0.83 RB1 (0.46) RB1VCPNR2E1
SCHEMBL7408196 0.82 RB1 (0.50) RB1VCPNR2E1CHRNA7
SCHEMBL7409258 0.82 RB1 (0.50) RB1VCPNR2E1CHRNA7

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
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