SCHEMBL7328496

SCHEMBL7328496

OC1(c2ccccc2)CN=C2CCCCN21

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.48
PABPC1 P11940 1/20 0.48
EIF4H Q15056 1/20 0.48
CTDSP1 Q9GZU7 1/20 0.48
HTT P42858 1/20 0.40
SLC6A2 P23975 3/20 0.38
SLC6A4 P31645 3/20 0.38
SLC6A3 Q01959 3/20 0.38
ALDH1A1 P00352 1/20 0.36
HSD11B1 P28845 5/20 0.35
HSD11B2 P80365 3/20 0.34
CYP2D6 P10635 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL14207322 0.98 HTR1A (0.50) HTR1APABPC1EIF4HCTDSP1HTT
SCHEMBL11743490 0.69 HTR1A (0.42) HTR1APABPC1EIF4HCTDSP1HTT
SCHEMBL7332894 0.68 HTR1A (0.44) HTR1APABPC1EIF4HCTDSP1HTT
SCHEMBL9719278 0.68 HTR1A (0.44) HTR1APABPC1EIF4HCTDSP1HTT
SCHEMBL544018 0.66 HTR1A (0.36) HTR1APABPC1EIF4HCTDSP1HTT
SCHEMBL7328915 0.65 HTR1A (0.38) HTR1APABPC1EIF4HCTDSP1HTT
SCHEMBL7327343 0.64 HTR1A (0.37) HTR1APABPC1EIF4HCTDSP1HTT
SCHEMBL11611860 0.64 SLC6A2 (0.41) HTR1APABPC1EIF4HCTDSP1SLC6A2
Methane SCHEMBL12474245 0.64 HTR1A (0.42) HTR1APABPC1EIF4HCTDSP1SLC6A2
SCHEMBL11715161 0.62 SLC6A2 (0.82) SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5198433-A Hypotensive MERRELL DOW PHARMACEUTICALS INC. (US) 1993-03-30 US disclosed
US-5158945-A Cardiotonic agents, vasodilators, hypotensive agents, anticonvulsants, antiisichemic agents MERRELL DOW PHARMACEUTICALS INC. (US) 1992-10-27 US disclosed
EP-0370320-B1 LACTAMIMIDES IN THE TREATMENT OF DRUG-RESISTANT PROTOZOAL INFECTIONS MERRELL DOW PHARMACEUTICALS INC. (US) 1992-09-30 EP disclosed
US-5128337-A Hypotensive agents MERRELL DOW PHARMACEUTICALS INC. (US) 1992-07-07 US disclosed
US-5082837-A Hypotensive MERRELL DOW PHARMACEUTICALS (US) 1992-01-21 US disclosed
US-5010072-A Hypotensive agents MERRELL DOW PHARMACEUTICALS INC. (US) 1991-04-23 US disclosed
EP-0370320-A1 Lactamimides in the treatment of drug-resistant protozoal infections MERRELL DOW PHARMACEUTICALS INC. (US) 1990-05-30 EP disclosed
US-4061746-A Lactamimide inhibitors of gastrointestinal hypersecretion RICHARDSON-MERRELL INC. (US) 1977-12-06 US disclosed