SCHEMBL6503383

SCHEMBL6503383

CC1CC[C](c2ccc(Cl)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
LMNA P02545 1/20 0.41
MITF O75030 1/20 0.38
RAB9A P51151 1/20 0.38
HRH3 Q9Y5N1 5/20 0.37
HSD11B1 P28845 1/20 0.37
SIGMAR1 Q99720 5/20 0.37
HRH2 P25021 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP1A2 P05177 1/20 0.36
MAPK13 O15264 1/20 0.35
MAPK12 P53778 1/20 0.35
MAPK11 Q15759 1/20 0.35
MAPK14 Q16539 1/20 0.35

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
SCHEMBL6075715 0.78 NPC1 (0.39) LMNARAB9ASIGMAR1CYP1A2MAPK13
SCHEMBL6077152 0.78 PDE7A (0.37) MAOAMAOBLMNARAB9AHRH3
SCHEMBL315185 0.78 LMNA (0.50) MAOBLMNARAB9ASIGMAR1CYP1A2
SCHEMBL218474 0.74 LMNA (0.44) MAOBLMNARAB9ASIGMAR1CYP1A2
SCHEMBL435618 0.74 LMNA (0.44) LMNARAB9ASIGMAR1CYP1A2
SCHEMBL434059 0.72 HTT (0.44) LMNARAB9ASIGMAR1CYP1A2
SCHEMBL8125538 0.72 HTT (0.44) LMNARAB9ASIGMAR1CYP1A2
SCHEMBL24367171 0.71 NOS3 (0.41) MAOAMAOBMITFRAB9AHRH3
SCHEMBL13503975 0.71 AKR1C3 (0.47) MAOAMAOBLMNASIGMAR1KMT2A
SCHEMBL30566630 0.68 SIGMAR1 (0.38) MAOAMAOBLMNAMITFRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6844347-B1 Cyclic guanosine monophosphate modulators; cardiovascular diseases; guanylate cyclase activation AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-01-18 US disclosed