SCHEMBL10909324

SCHEMBL10909324

CC(=O)c1cccc(N)c1OC(=O)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ELANE P08246 12/20 0.46
PRTN3 P24158 1/20 0.42
ALDH1A1 P00352 4/20 0.39
HSD17B10 Q99714 3/20 0.39
CFTR P13569 1/20 0.39
PARP1 P09874 1/20 0.37
PARP2 Q9UGN5 1/20 0.37
BRD4 O60885 1/20 0.37
MMP2 P08253 1/20 0.36
KDM4E B2RXH2 2/20 0.35
GLA P06280 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL19719013 0.82 ELANE (0.47) ELANEPRTN3
SCHEMBL4887181 0.80 ELANE (0.53) ELANESMN1; SMN2MAPK1
SCHEMBL7106629 0.78 ALDH1A1 (0.48) ALDH1A1HSD17B10CFTRBRD4MMP2
SCHEMBL7391282 0.77 ALDH1A1 (0.42) ELANEALDH1A1HSD17B10CFTRBRD4
SCHEMBL14329352 0.76 ALDH1A1 (0.43) ALDH1A1HSD17B10CFTRBRD4MMP2
SCHEMBL10896090 0.76 ALDH1A1 (0.46) ELANEPRTN3ALDH1A1GLASMN1; SMN2
SCHEMBL9079554 0.75 ALDH1A1 (0.41) ALDH1A1HSD17B10CFTRBRD4MMP2
SCHEMBL7163203 0.71 HSD17B10 (0.67) ALDH1A1HSD17B10CFTRMMP2KDM4E
SCHEMBL27615323 0.70 ADRB1 (0.42) ALDH1A1HSD17B10KDM4EHPGD
SCHEMBL28030915 0.70 ELANE (0.42) ELANEALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10176887-B1 Ex vivo methods for drug discovery, development and testing ORGAN RECOVERY SYSTEMS, INC. (US) 2019-01-08 US claimed
US-10176887-B1 Ex vivo methods for drug discovery, development and testing ORGAN RECOVERY SYSTEMS, INC. (US) 2019-01-08 US disclosed
US-4621053-A Process for the production of human peptide hormones KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 1986-11-04 US disclosed
US-4618624-A 3-amino-4-hydroxy(or alkoxy)phenethanolamine derivatives and pharmacologically-acceptable acid addition salts thereof for increasing the growth rate and/or improving the lean meat to fat ratio of warm-blooded animals AMERICAN CYANAMID COMPANY (US) 1986-10-21 US disclosed
EP-0080595-B1 ALKANESULFONANILIDE DERIVATIVES AND PHARMACEUTICALLY ACCEPTABLE ACID ADDITION SALTS THEREOF AMERICAN CYANAMID COMPANY (US) 1985-05-29 EP disclosed
US-4477680-A 3-Amino-4-hydroxy(or alkoxy)phenethanolamine derivatives and _pharmacologically acceptable acid addition salts thereof for _increasing the growth rate and/or improving the lean meat to fat _ratio of warm-blooded animals AMERICAN CYANAMID COMPANY (US) 1984-10-16 US disclosed