SCHEMBL7534159

SCHEMBL7534159

COc1ccc(NC(=O)NOCC(O)CN2CCCCC2)cc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.62
▸ POLB P06746 2/20 0.62
▸ ALDH1A1 P00352 2/20 0.58
▸ MAPT P10636 1/20 0.58
▸ ALOX15 P16050 1/20 0.58
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ ABCB1 P08183 3/20 0.54
▸ ATM Q13315 1/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ HRH3 Q9Y5N1 1/20 0.51
▸ CYP2D6 P10635 2/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ TSHR P16473 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48

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
SCHEMBL8610389 0.96 KDM4E (0.57) KDM4EPOLBALDH1A1MAPTALOX15
SCHEMBL7523557 0.87 POLB (0.55) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL15445664 0.80 TSHR (0.72) KDM4EPOLBALDH1A1MAPTALOX15
SCHEMBL8610392 0.79 POLB (0.56) KDM4EPOLBALDH1A1MAPTALOX15
SCHEMBL3175907 0.79 ALDH1A1 (0.56) ALDH1A1MAPTMEN1KMT2AABCB1
SCHEMBL7559747 0.79 PRMT5 (0.46) KDM4EPOLBABCB1ATMCYP2D6
SCHEMBL6009221 0.77 ABCB1 (0.52) KDM4EPOLBALDH1A1MAPTMEN1
SCHEMBL7526130 0.77 ABCB1 (0.49) KDM4EPOLBALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL7486372 0.76 ABCB1 (0.51) KDM4EPOLBALDH1A1MAPTMEN1
SCHEMBL7525705 0.76 HRH3 (0.52) ALDH1A1MAPTMEN1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832079-B1 ANTI-ISCHAEMIC HYDROXYLAMINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS BIOREX KUTATO FEJLESZTOE KFT (HU) 2002-03-27 — — EP disclosed
US-6002002-A Anti-ischaemic hydroxylamine derivatives and pharmaceutical compositions BIOREX RESEARCH & DEVELOPMENT CO. (HU) 1999-12-14 — — US disclosed
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