SCHEMBL9792247

SCHEMBL9792247

COc1ccc(C(=O)N2CCOCC2)cc1

nearest known ligand 0.79

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.79
POLB P06746 4/20 0.77
ALDH1A1 P00352 3/20 0.77
SMN1; SMN2 Q16637 2/20 0.77
L3MBTL1 Q9Y468 1/20 0.68
KMT2A Q03164 3/20 0.68
MEN1 O00255 1/20 0.68
RAB9A P51151 1/20 0.68
LMNA P02545 2/20 0.63
MAPT P10636 2/20 0.63
KDM4E B2RXH2 1/20 0.63
HTT P42858 1/20 0.63
PHGDH O43175 1/20 0.63
FKBP1A P62942 1/20 0.61
AKR1C3 P42330 1/20 0.61
BLM P54132 1/20 0.61
GAA P10253 1/20 0.61
TSHR P16473 1/20 0.61
GLA P06280 1/20 0.61

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
SCHEMBL20631562 0.88 HPGD (0.86) HPGDPOLBALDH1A1L3MBTL1KMT2A
Molracetam SCHEMBL2109861 0.87 HPGD (0.65) HPGDPOLBALDH1A1SMN1; SMN2KMT2A
SCHEMBL10720943 0.86 PHGDH (0.81) HPGDPOLBALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL2534411 0.84 HPGD (1.00) HPGDPOLBALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL28614894 0.84 BLM (0.62) HPGDPOLBALDH1A1SMN1; SMN2KMT2A
SCHEMBL6456595 0.83 L3MBTL1 (0.73) HPGDPOLBALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7422569 0.83 HPGD (0.74) HPGDPOLBALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL15976788 0.83 PHGDH (0.63) HPGDPOLBALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL2535536 0.83 HPGD (0.96) HPGDPOLBALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL19479126 0.82 ALDH1A1 (0.83) HPGDPOLBALDH1A1SMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119504653-A Carboxylic acid amidation method 国网安徽省电力有限公司电力科学研究院 2025-02-25 CN disclosed
CN-111574477-B Synthesis method of amide compound 湖南大学 2024-06-28 CN disclosed
CN-111574477-A Synthesis method of amide compound 湖南大学 2020-08-25 CN disclosed
CN-104321325-B Pyrrolopyrrole alkanone compound 诺华股份有限公司 2016-11-16 CN disclosed
EP-2380891-A1 Substituted piperidino-dihydrothienopyrimidines BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-10-26 EP disclosed
US-4988822-A Intermediates for preparing 5-aroyl-1,2-dihydro-3H-pyrrolo(1,2-A)pyrrole-1,1-dicarboxylates SYNTEX (U.S.A.) INC. (US) 1991-01-29 US disclosed
US-4873340-A Process for preparing 5-aroyl-1,2-dihydro-3H-pyrrolo[1,2-A]pyrrole-1,1-dicarboxylates SYNTEX (U.S.A.) INC. (US) 1989-10-10 US disclosed
EP-0053021-B1 PROCESS FOR 5-AROYLATION OF 1,2-DIHYDRO-3H-PYRROLO(1,2-A)PYRROLE-1-CARBOXYLIC ESTERS AND NITRILES SYNTEX (U.S.A.) INC. (US) 1985-05-02 EP disclosed
US-4353829-A AROYL MORPHOLIDE REAGENT SYNTEX (U.S.A.) INC. (US) 1982-10-12 US disclosed
EP-0053021-A2 Process for 5-aroylation of 1,2-dihydro-3H-pyrrolo(1,2-a)pyrrole-1-carboxylic esters and nitriles SYNTEX (U.S.A.) INC. (US) 1982-06-02 EP disclosed