SCHEMBL5604045

SCHEMBL5604045

CCCC1CCC2=C1c1ccccc1[N]2

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.33
NPC1 O15118 1/20 0.30
CASP3 P42574 1/20 0.30
RAB9A P51151 1/20 0.30
SENP8 Q96LD8 1/20 0.30
NLRP3 Q96P20 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 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
SCHEMBL5612150 0.91 BCHE (0.31)
SCHEMBL5612147 0.90 BCHE (0.30)
SCHEMBL5603688 0.89 CYP1A2 (0.31)
SCHEMBL5602940 0.89 CYP1A2 (0.31)
SCHEMBL5604124 0.89 CYP1A2 (0.31)
SCHEMBL5602803 0.89 CYP1A2 (0.31)
SCHEMBL5600916 0.89 CYP1A2 (0.31)
SCHEMBL5603623 0.89 CYP1A2 (0.31)
SCHEMBL5604011 0.89 CYP1A2 (0.31)
SCHEMBL5612680 0.88 CYP19A1 (0.30) CYP19A1

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-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US claimed