SCHEMBL11534940

SCHEMBL11534940

CC=CC(=O)N(CCCC)c1nc(C)co1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.38
LMNA P02545 1/20 0.38
ELANE P08246 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
HTT P42858 1/20 0.32
THRA P10827 1/20 0.30
THRB P10828 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
SCHEMBL11542256 1.00 CYP3A4 (0.38) CYP3A4LMNAELANETRPM8HTT
SCHEMBL11540044 0.85 ELANE (0.35) ELANE
SCHEMBL11537406 0.84 ELANE (0.37) ELANE
SCHEMBL11528025 0.83 TRPM8 (0.48) ELANETRPM8HTT
SCHEMBL11528023 0.83 TRPM8 (0.48) ELANETRPM8HTT
SCHEMBL11535507 0.82 ELANE (0.49) ELANE
SCHEMBL11537403 0.82 ELANE (0.37) ELANE
SCHEMBL11537091 0.81 ELANE (0.37) ELANE
SCHEMBL11374453 0.80 ELANE (0.36) CYP3A4ELANE
SCHEMBL11528434 0.80 ELANE (0.36) LMNAELANE

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-4150143-A N-Substituted-acylamino-oxazoles as antiasthma agents LILLY INDUSTRIES LIMITED (GB) 1979-04-17 US disclosed
US-4143047-A 2-SULFINYL AND 2-SULFONYL OXAZOLES LILLY INDUSTRIES LIMITED (GB) 1979-03-06 US disclosed
US-4122183-A ANTIASTHMATIC LILLY INDUSTRIES LIMITED (GB) 1978-10-24 US disclosed