SCHEMBL7449374

SCHEMBL7449374

O=C(NN1CCC(Cc2ccccc2)CC1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.60
HTT P42858 1/20 0.58
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
SLC6A2 P23975 2/20 0.55
SLC6A4 P31645 2/20 0.55
FAAH O00519 1/20 0.55
RAB9A P51151 1/20 0.53

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
SCHEMBL9591405 0.84 MEN1 (0.56) CCR3MEN1KMT2AFAAH
SCHEMBL5374680 0.80 ACHE (0.56) CCR3SLC6A2SLC6A4
SCHEMBL5373096 0.78 GRIN2B (0.53) MEN1KMT2A
SCHEMBL28138491 0.78 HTT (0.65) HTTKMT2A
SCHEMBL11389740 0.78 TACR3 (0.57) MEN1KMT2AFAAH
SCHEMBL4986574 0.78 CCR3 (0.51) CCR3HTTMEN1KMT2AFAAH
SCHEMBL7232379 0.77 HTT (0.73) HTTMEN1KMT2ARAB9A
SCHEMBL2399935 0.76 HTT (0.96) HTTKMT2ARAB9A
SCHEMBL6570865 0.75 HTT (0.66) HTTMEN1KMT2AFAAH
SCHEMBL15007990 0.75 CCR3 (0.51) CCR3HTTMEN1KMT2AFAAH

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-6410540-B1 HEART AND KIDNEY DISEASES; ANTIINFLAMMATORY AGENTS SCIOS, INC. 2002-06-25 US disclosed
WO-2001064676-A2 INHIBITORS OF p38-α KINASE SCIOS, INC. (US) 2001-09-07 WO disclosed
EP-1107758-A2 USE OF PIPERIDINES AND/OR PIPERAZINES AS INHIBITORS OF P38-ALPHA KINASE SCIOS INC. (US) 2001-06-20 EP disclosed
WO-2000012074-A2 USE OF PIPERIDINES AND/OR PIPERAZINES AS INHIBITORS OF P38-ALPHA KINASE SCIOS INC. (US) 2000-03-09 WO disclosed