SCHEMBL8531930

SCHEMBL8531930

Oc1cccc(CC(c2ccccc2)N2CCNCC2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 19/20 1.00
▸ SLC6A2 P23975 12/20 1.00
▸ SLC6A3 Q01959 4/20 1.00
▸ TACR1 P25103 1/20 0.55

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
SCHEMBL31061390 1.00 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3TACR1
SCHEMBL6171525 0.85 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3
SCHEMBL5448643 0.84 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3TACR1
SCHEMBL11505135 0.82 SLC6A4 (0.69) SLC6A4SLC6A2SLC6A3
SCHEMBL11504855 0.81 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3TACR1
Hydrochloric Acid SCHEMBL11504975 0.81 SLC6A4 (0.67) SLC6A4SLC6A2SLC6A3
SCHEMBL11504505 0.80 SLC6A4 (0.66) SLC6A4SLC6A2SLC6A3
SCHEMBL11505429 0.80 SLC6A4 (0.66) SLC6A4SLC6A2SLC6A3TACR1
SCHEMBL11505065 0.79 SLC6A4 (0.65) SLC6A4SLC6A2SLC6A3
SCHEMBL11505294 0.79 SLC6A4 (0.65) SLC6A4SLC6A2SLC6A3

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-5854249-A Opioid diarylmethylpiperazines and piperidines DELTA PHARMACEUTICALS, INC. (US) 1998-12-29 — — US disclosed
US-5681830-A DIARYLMETHYL PIPERAZINE COMPOUNDS HAVING UTILITY IN MEDICAL THERAPY AS RECEPTOR-BINDING SPECIES DELTA PHARMACEUTICALS, INC. (US) 1997-10-28 — — US disclosed
US-4162316-A ANALGESICS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1979-07-24 — — US disclosed
US-4080453-A ANALGESICS, ANTITUSSIVE DAINIPPON PHARMACEUTICAL CO., LTD. (JA) 1978-03-21 — — US disclosed
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