SCHEMBL11610029

SCHEMBL11610029

CC(C)C(C)(C(=O)O)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.46
▸ ELANE P08246 1/20 0.43
▸ CA12 O43570 2/20 0.41
▸ CA9 Q16790 2/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ SCN2A Q99250 1/20 0.41
▸ TP53 P04637 2/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ CYP2D6 P10635 2/20 0.41
▸ POLB P06746 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41

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
SCHEMBL9603154 0.85 ELANE (0.46) LMNAELANETP53ALDH1A1CYP2D6
SCHEMBL11611823 0.85 ELANE (0.42) LMNAELANECA12CA9TP53
SCHEMBL5706500 0.80 CA12 (0.47) LMNACA12CA9CA1CA2
SCHEMBL11773645 0.77 ALDH1A1 (0.53) TP53ALDH1A1CYP2D6POLBKDM4E
SCHEMBL1925782 0.73 MALT1 (0.41) LMNATP53POLB
SCHEMBL28496305 0.73 LMNA (0.41) LMNAELANESCN2ATP53ALDH1A1
SCHEMBL28648868 0.72 LMNA (0.58) LMNATP53ALDH1A1CYP2D6POLB
SCHEMBL19852093 0.72 LMNA (0.43) LMNAELANECA12CA9TP53
SCHEMBL9944717 0.71 CASP3 (0.43) LMNACA12CA9ALDH1A1POLB
SCHEMBL21424558 0.71 CA12 (0.43) LMNACA12CA9ALDH1A1HSD17B10

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-4125727-A Method of preparing imidazoisoindolediones AMERICAN CYANAMID COMPANY (US) 1978-11-14 — — US disclosed
US-4062671-A Imidazoisoindolediones, and the use thereof as herbicidal agents AMERICAN CYANAMID COMPANY (US) 1977-12-13 — — US disclosed
US-4017510-A ENANTIOMORPHS AMERICAN CYANAMID COMPANY (US) 1977-04-12 — — US disclosed
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