SCHEMBL9174733

SCHEMBL9174733

CC(=O)OCCN1C(=O)c2ccccc2OC1C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.40
▸ SLC18A3 Q16572 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ APEX1 P27695 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ GAA P10253 1/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ ELANE P08246 1/20 0.38
▸ PTGS2 P35354 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ HPGD P15428 2/20 0.37
▸ LMNA P02545 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ RXFP1 Q9HBX9 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
SCHEMBL9174736 0.84 ALDH1A1 (0.41) ALDH1A1SLC18A3HSD17B10GAA
SCHEMBL8576377 0.81 KDM4E (0.40) ALDH1A1KMT2A
SCHEMBL9303669 0.80 CA2 (0.35) ALDH1A1POLBHSD17B10GAAKMT2A
SCHEMBL9175683 0.79 RAB9A (0.34) ALDH1A1KMT2APTGS2LMNA
SCHEMBL9172583 0.78 PARP1 (0.43) HSD17B10KMT2AMEN1
SCHEMBL8574206 0.76 HPGD (0.46) ALDH1A1TDP1KMT2ASMN1; SMN2HPGD
SCHEMBL8796640 0.75 RAB9A (0.44) ALDH1A1POLBSMN1; SMN2HPGDLMNA
SCHEMBL8576526 0.75 SMN1; SMN2 (0.33) GAASMN1; SMN2HPGD
SCHEMBL8638816 0.73 ALDH1A1 (0.41) ALDH1A1SLC18A3GAAELANEPTGS2
SCHEMBL10495293 0.71 SMN1; SMN2 (0.67) ALDH1A1POLBAPEX1HSD17B10TDP1

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
EP-0490183-B1 Benzoxazinone and benzothiazinone derivatives endowed with cardiovascular activity ITALFARMACO SPA (IT) 1995-04-19 — — EP disclosed
US-5189034-A Vasodilating, antianginal agents ITALFARMACO S.P.A. (IT) 1993-02-23 — — US disclosed
EP-0490183-A1 Benzoxazinone and benzothiazinone derivatives endowed with cardiovascular activity ITALFARMACO S.p.A. (IT) 1992-06-17 — — EP disclosed
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