SCHEMBL9711510

SCHEMBL9711510

COc1ccc(C(=O)C2C(=O)CC(c3ccccc3)NC2=O)c([N+](=O)[O-])c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.43
ALDH1A1 P00352 6/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
PKM P14618 1/20 0.43
AKR1C3 P42330 2/20 0.42
AKR1C2 P52895 2/20 0.42
SMN1; SMN2 Q16637 4/20 0.41
RAB9A P51151 4/20 0.41
NPC1 O15118 3/20 0.41
MAPK1 P28482 1/20 0.41
AKR1B10 O60218 1/20 0.40
AKR1B1 P15121 1/20 0.40
AKR1C4 P17516 1/20 0.40
AKR1C1 Q04828 1/20 0.40
HTT P42858 1/20 0.39
HPD P32754 1/20 0.39
KDM4E B2RXH2 2/20 0.38

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
SCHEMBL9711468 0.87 SMN1; SMN2 (0.38) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL9711524 0.85 MAPT (0.42) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL9711509 0.85 HPGD (0.43) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL9711609 0.85 HPD (0.40) ALDH1A1LMNAHPD
SCHEMBL9711636 0.84 KMT2A (0.41) ALDH1A1MEN1KMT2AHTTHPD
SCHEMBL9711506 0.82 HPD (0.61) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL9711693 0.81 MEN1 (0.42) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL9711701 0.79 ALDH1A1 (0.43) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL9711533 0.78 NPC1 (0.43) ALDH1A1KMT2ALMNASMN1; SMN2RAB9A
SCHEMBL9711538 0.78 HPD (0.46) MAPTALDH1A1MEN1KMT2ALMNA

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
US-5114461-A Herbicides MAY & BAKER LIMITED (GB) 1992-05-19 US disclosed
EP-0278742-A2 Cyclic diones MAY & BAKER LIMITED (GB) 1988-08-17 EP disclosed