SCHEMBL9592720

SCHEMBL9592720

CCCOc1ccc(CN2CCC(NC(=O)NC(=O)c3ccccc3)CC2)cc1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DRD4 P21917 1/20 0.72
▸ UTS2R Q9UKP6 1/20 0.59
▸ FAAH O00519 1/20 0.57
▸ ADIPOR2 Q86V24 1/20 0.56
▸ ADIPOR1 Q96A54 1/20 0.56
▸ USP2 O75604 1/20 0.56
▸ SLC6A5 Q9Y345 1/20 0.55
▸ MCHR1 Q99705 3/20 0.54
▸ POLB P06746 1/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ SIGMAR1 Q99720 1/20 0.53
▸ HRH3 Q9Y5N1 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL9594182 0.96 DRD4 (0.72) DRD4UTS2RADIPOR2ADIPOR1USP2
SCHEMBL9871439 0.92 UTS2R (0.69) DRD4UTS2RADIPOR2ADIPOR1USP2
SCHEMBL9591654 0.86 DRD4 (0.84) DRD4MCHR1POLBMEN1KMT2A
SCHEMBL8786936 0.85 DRD4 (1.00) DRD4MCHR1MEN1KMT2ASIGMAR1
SCHEMBL10904068 0.85 DRD4 (0.77) DRD4MCHR1POLBMEN1KMT2A
SCHEMBL9592422 0.83 DRD4 (0.79) DRD4MCHR1MEN1KMT2ASIGMAR1
SCHEMBL9592321 0.82 DRD4 (0.80) DRD4SLC6A5MCHR1MEN1KMT2A
SCHEMBL9592555 0.81 DRD4 (0.79) DRD4FAAHMCHR1POLBMEN1
SCHEMBL9592647 0.81 MCHR1 (0.70) DRD4MCHR1SIGMAR1
Panuramine SCHEMBL2037759 0.80 MCHR1 (0.83) DRD4MCHR1MEN1KMT2ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0035374-B1 PIPERIDYL - UREA, - THIOUREA AND - GUANIDINE DERIVATIVES, AND INTERMEDIATES THEREFOR, PROCESSES FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE DERIVATIVES JOHN WYETH & BROTHER LIMITED (GB) 1985-01-30 — — EP claimed
US-4426387-A Piperid-4-yl ureas and thio ureas used as anti-depressant agents JOHN WYETH & BROTHER LTD. (GB) 1984-01-17 — — US claimed
EP-0035374-A2 Piperidyl - urea, - thiourea and - guanidine derivatives, and intermediates therefor, processes for preparing them and pharmaceutical compositions containing the derivatives JOHN WYETH & BROTHER LIMITED (GB) 1981-09-09 — — EP claimed
US-5212179-A Antidepressants JOHN WYETH AND BROTHER LIMITED (GB) 1993-05-18 — — US disclosed
US-4985438-A PSYCHOTROPIC ACTIVITY, ANTIDEPRESSANTS JOHN WYETH & BROTHER, LIMITED (GB) 1991-01-15 — — US disclosed
US-4806552-A ANTIDEPRESSANTS JOHN WYETH & BROTHER, LIMITED (GB) 1989-02-21 — — US disclosed
US-4722930-A ANTIDEPRESSANTS JOHN WYETH AND BROTHER LIMITED (GB) 1988-02-02 — — US disclosed
US-4563466-A ANTISEROTONINE JOHN WYETH & BROTHER LIMITED (GB) 1986-01-07 — — US disclosed
US-4426387-A Piperid-4-yl ureas and thio ureas used as anti-depressant agents JOHN WYETH & BROTHER LTD. (GB) 1984-01-17 — — US disclosed
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