SCHEMBL6486783

SCHEMBL6486783

FCCCN1CC[N]CC1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.37
HRH3 Q9Y5N1 1/20 0.35
KEAP1 Q14145 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALOX15 P16050 1/20 0.32
ACE2 Q9BYF1 1/20 0.30

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
SCHEMBL6485116 0.93 HRH3 (0.39) SIGMAR1HRH3KEAP1SMN1; SMN2ALOX15
SCHEMBL6487786 0.91 HRH3 (0.39) SIGMAR1HRH3SMN1; SMN2
SCHEMBL1886906 0.84
SCHEMBL11569068 0.81
SCHEMBL1480820 0.80 KEAP1 (0.54) SIGMAR1KEAP1SMN1; SMN2ALOX15ACE2
SCHEMBL6475492 0.78 HTR1A (0.31) SIGMAR1
SCHEMBL42822 0.77 HRH3 (0.55) SIGMAR1HRH3SMN1; SMN2
SCHEMBL6485505 0.76 HRH3 (0.32) HRH3
SCHEMBL19273693 0.76
SCHEMBL22915903 0.76

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-6962911-B2 Pyrrolopyrimidinone derivatives, process of preparation and use SK CHEMICALS CO., LTD. (KR) 2005-11-08 US disclosed
EP-1257553-B1 PYRROLOPYRIMIDINONE DERIVATIVES, PROCESS OF PREPARATION AND USE SK CHEMICALS CO LTD (KR) 2004-05-26 EP disclosed
EP-1257553-A1 PYRROLOPYRIMIDINONE DERIVATIVES, PROCESS OF PREPARATION AND USE SK Chemicals Co., Ltd. (KR) 2002-11-20 EP disclosed
WO-2001060825-A1 PYRROLOPYRIMIDINONE DERIVATIVES, PROCESS OF PREPARATION AND USE SK CHEMICALS CO., LTD. (KR) 2001-08-23 WO disclosed