SCHEMBL8146239

SCHEMBL8146239

CCCCCCN1CCN(CCCCCC)C1=S

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
GNAI3 P08754 3/20 0.41
GNAO1 P09471 3/20 0.41
GNAI1 P63096 3/20 0.41
GBA1 P04062 1/20 0.40
ALOX5 P09917 2/20 0.38
PTGS1 P23219 3/20 0.38
PTGS2 P35354 3/20 0.38
MGLL Q99685 3/20 0.38
FAAH O00519 2/20 0.38
EEF2K O00418 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36

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
SCHEMBL8034075 0.91 KMT2A (0.55) MEN1KMT2AALDH1A1CYP1A2CYP2D6
SCHEMBL20204699 0.87 MEN1 (0.44) MEN1KMT2AGNAI3GNAO1GNAI1
SCHEMBL20204676 0.82 MEN1 (0.41) MEN1KMT2AGNAI3GNAO1GNAI1
SCHEMBL20201643 0.81 MEN1 (0.40) MEN1KMT2AGNAI3GNAO1GNAI1
SCHEMBL18183389 0.78 MEN1 (0.38) MEN1KMT2AALDH1A1THRB
SCHEMBL9769271 0.77 GBA1 (0.47) GNAI3GNAO1GNAI1GBA1ALOX5
SCHEMBL31093244 0.77 GBA1 (0.47) GNAI3GNAO1GNAI1GBA1ALOX5
SCHEMBL9769185 0.77 GBA1 (0.47) GNAI3GNAO1GNAI1GBA1ALOX5
SCHEMBL31093212 0.77 GBA1 (0.47) GNAI3GNAO1GNAI1GBA1ALOX5
SCHEMBL9617015 0.77 GBA1 (0.47) GNAI3GNAO1GNAI1GBA1ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6025496-A Process for preparing heterocyclic carbenes CELANESE GMBH (DE) 2000-02-15 US disclosed
EP-0888308-A1 PROCESS FOR PREPARING HETEROCYCLIC CARBENES Celanese GmbH (DE) 1999-01-07 EP disclosed
WO-1997034875-A1 PROCESS FOR PREPARING HETEROCYCLIC CARBENES CELANESE GMBH (DE) 1997-09-25 WO disclosed