SCHEMBL11284006

SCHEMBL11284006

CC(C)(C)C(=O)OCc1cc(C(=O)C(N)C(C)(C)C)ccc1OC(=O)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ELANE P08246 16/20 0.46
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
CYP3A4 P08684 1/20 0.38
HIF1A Q16665 1/20 0.38
ADRB2 P07550 1/20 0.37
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
RECQL P46063 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL11282374 0.85 KMT2A (0.39) ELANEALDH1A1LMNAADRB2MEN1
SCHEMBL11284109 0.83 ELANE (0.53) ELANEALDH1A1MEN1MAPTRECQL
SCHEMBL11290593 0.83 ALDH1A1 (0.46) ELANEALDH1A1LMNACYP3A4HIF1A
Hydrochloric Acid SCHEMBL11282567 0.82 ADRB2 (0.47) ELANEALDH1A1LMNACYP3A4HIF1A
SCHEMBL11279189 0.81 ALOX15 (0.42) ELANEALDH1A1MEN1MAPTRECQL
SCHEMBL11282093 0.81 ELANE (0.42) ELANEALDH1A1LMNACYP3A4HIF1A
SCHEMBL11109081 0.79 ELANE (0.49) ELANEALDH1A1LMNACYP3A4HIF1A
SCHEMBL11102277 0.79 ELANE (0.47) ELANEALDH1A1LMNACYP3A4HIF1A
Hydrochloric Acid SCHEMBL11283476 0.78 ALDH1A1 (0.36) ALDH1A1MEN1MAPTRECQLKMT2A
SCHEMBL11288055 0.77 ALOX15 (0.49) ELANEALDH1A1LMNACYP3A4HIF1A

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-4336400-A BRONCHODILATOR AGENTS, CARDIOVASCULAR STIMULANTS STERLING DRUG INC. (US) 1982-06-22 US disclosed
US-RE30241-E BRONCHODILATION, ADRENERGIC STIMULANTS STERLING DRUG INC. (US) 1980-03-25 US disclosed
US-4138581-A BRONCHODILATOR AGENTS, ADRENERGIC STIMULANTS STERLING DRUGS INC. (US) 1979-02-06 US disclosed