SCHEMBL17370205

SCHEMBL17370205

CCC(C)(C)C(=O)OC(C)(C)C1CCC(O)CC1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP13 P45452 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
RIPK1 Q13546 1/20 0.30
FKBP1A P62942 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
SCHEMBL11941655 0.93 HMGCR (0.33) HMGCRRIPK1FKBP1A
SCHEMBL15473003 0.88 HSD11B1 (0.37) HMGCRRIPK1FKBP1A
SCHEMBL13427314 0.88 CCR2 (0.31) HMGCRRIPK1FKBP1A
SCHEMBL107703 0.86 HMGCR (0.33) HMGCRFKBP1A
SCHEMBL12040366 0.86 HMGCR (0.30) HMGCRFKBP1A
SCHEMBL107891 0.86 FKBP1A (0.37) HMGCRCHRM2CHRM1CHRM3RIPK1
SCHEMBL15473009 0.85 LIPA (0.32)
SCHEMBL18802879 0.84 FKBP1A (0.36) HMGCRCHRM2CHRM1CHRM3RIPK1
SCHEMBL106966 0.84 FKBP1A (0.36) HMGCRCHRM2CHRM1CHRM3RIPK1
SCHEMBL18802861 0.84 FKBP1A (0.36) HMGCRCHRM2CHRM1CHRM3RIPK1

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-20150378257-A1 PATTERN FORMING METHOD, ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, METHOD OF MANUFACTURING ELECTRONIC DEVICE, AND ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2015-12-31 US disclosed