SCHEMBL19387397

SCHEMBL19387397

CCCCC(C)(C)C(=O)OCCCN

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.46
CYP4A11 Q02928 1/20 0.46
ALDH1A1 P00352 1/20 0.39
ATM Q13315 1/20 0.37
HTR2C P28335 1/20 0.37
NAAA Q02083 1/20 0.36
FDPS P14324 1/20 0.36
CYP1A2 P05177 1/20 0.36
TSHR P16473 3/20 0.35
HPGD P15428 1/20 0.35
ELANE P08246 1/20 0.34
EPHX1 P07099 1/20 0.34
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ACHE P22303 3/20 0.33
ESR1 P03372 1/20 0.33

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
SCHEMBL24943509 0.93 CYP4F2 (0.51) CYP4F2CYP4A11ALDH1A1ATMHTR2C
SCHEMBL20180944 0.93 CYP4F2 (0.51) CYP4F2CYP4A11ALDH1A1ATMHTR2C
SCHEMBL15371643 0.91 CYP4F2 (0.47) CYP4F2CYP4A11ALDH1A1ATMHTR2C
SCHEMBL19359962 0.89 CYP4F2 (0.52) CYP4F2CYP4A11ALDH1A1ATMNAAA
SCHEMBL27898238 0.88 CYP4F2 (0.50) CYP4F2CYP4A11ALDH1A1HTR2CNAAA
SCHEMBL27362196 0.88 CYP4F2 (0.50) CYP4F2CYP4A11ALDH1A1HTR2CNAAA
SCHEMBL27204893 0.85 CYP4F2 (0.53) CYP4F2CYP4A11ALDH1A1NAAATSHR
SCHEMBL19018809 0.85 CYP4F2 (0.52) CYP4F2CYP4A11ALDH1A1ATMNAAA
SCHEMBL15780654 0.84 CYP4F2 (0.61) CYP4F2CYP4A11ALDH1A1ATMNAAA
Ammonia Solution, Strong SCHEMBL28636353 0.84 CYP4F2 (0.51) CYP4F2CYP4A11ALDH1A1NAAATSHR

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-9770519-B2 Protein-polymer-drug conjugates MERSANA THERAPEUTICS, INC. (US) 2017-09-26 US disclosed