SCHEMBL800007

SCHEMBL800007

CCC(C)(C)C(=O)OC(CC(C)(C)O)C1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 7/20 0.37
HMGCR P04035 2/20 0.34
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
SHBG P04278 1/20 0.31
CCR2 P41597 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
SCHEMBL2682078 0.86 PDK1 (0.35) FKBP1AHMGCR
SCHEMBL10181996 0.86 PDK1 (0.35) FKBP1AHMGCR
SCHEMBL9241612 0.85 FKBP1A (0.33) FKBP1AHMGCR
SCHEMBL13520510 0.81 FKBP1A (0.34) FKBP1AHMGCR
SCHEMBL13520512 0.80 HMGCR (0.34) FKBP1AHMGCR
SCHEMBL16659680 0.80 HMGCR (0.38) FKBP1AHMGCRPOLBSHBGCCR2
SCHEMBL10115888 0.80 HMGCR (0.38) FKBP1AHMGCRALDH1A1POLBSHBG
SCHEMBL13223870 0.79 FKBP1A (0.40) FKBP1AHMGCRPOLB
SCHEMBL10171001 0.78 FKBP1A (0.31) FKBP1A
SCHEMBL13520504 0.78 HMGCR (0.37) FKBP1AHMGCR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546062-B2 Self-forming top anti-reflective coating compositions and, photoresist mixtures and method of imaging using same INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-10-01 US disclosed
US-20120070782-A1 SELF-FORMING TOP ANTI-REFLECTIVE COATING COMPOSITIONS AND, PHOTORESIST MIXTURES AND METHOD OF IMAGING USING SAME INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-03-22 US disclosed