SCHEMBL5602597

SCHEMBL5602597

CC1=C[N]C(C2CCCCC2)=N1

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.30
RAB9A P51151 2/20 0.30
PSMB5 P28074 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
SCHEMBL5601236 1.00 NPC1 (0.30) NPC1RAB9APSMB5
SCHEMBL5600325 1.00 NPC1 (0.30) NPC1RAB9APSMB5
SCHEMBL5600581 1.00 NPC1 (0.30) NPC1RAB9APSMB5
SCHEMBL5602570 1.00 NPC1 (0.30) NPC1RAB9APSMB5
SCHEMBL5600654 1.00 NPC1 (0.30) NPC1RAB9APSMB5
SCHEMBL5603278 1.00 NPC1 (0.30) NPC1RAB9APSMB5
SCHEMBL5603428 0.98
SCHEMBL5601148 0.94
SCHEMBL5603023 0.89
SCHEMBL27921716 0.75 TDO2 (0.36) NPC1RAB9A

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-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US claimed
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed