SCHEMBL9474762

SCHEMBL9474762

O=C(Nc1ccc(OC(=O)c2ccc([N+](=O)[O-])cc2)cc1)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 8/20 0.72
▸ MAPT P10636 6/20 0.72
▸ RAB9A P51151 5/20 0.72
▸ NPC1 O15118 4/20 0.72
▸ SMN1; SMN2 Q16637 3/20 0.72
▸ MEN1 O00255 6/20 0.69
▸ HTT P42858 2/20 0.69
▸ PKM P14618 1/20 0.65
▸ MITF O75030 2/20 0.64
▸ POLB P06746 2/20 0.64
▸ LMNA P02545 2/20 0.62
▸ ALDH1A1 P00352 1/20 0.59
▸ MAPK1 P28482 2/20 0.59
▸ HGFAC Q04756 1/20 0.58
▸ ATM Q13315 1/20 0.56
▸ NPSR1 Q6W5P4 2/20 0.56
▸ MYOC Q99972 1/20 0.56
▸ ALOX5 P09917 1/20 0.56

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
SCHEMBL18434657 0.86 KMT2A (0.84) KMT2AMAPTRAB9AHTTPKM
SCHEMBL8572381 0.86 KMT2A (0.83) KMT2AMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL10636579 0.86 KMT2A (0.84) KMT2AMAPTRAB9AHTTPKM
SCHEMBL4951809 0.86 KMT2A (0.84) KMT2AMAPTRAB9AHTTPKM
SCHEMBL9134339 0.86 KMT2A (0.83) KMT2AMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL23898948 0.86 KMT2A (0.83) KMT2AMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL542043 0.86 KMT2A (0.84) KMT2AMAPTRAB9AHTTPKM
SCHEMBL8274340 0.85 KMT2A (0.81) KMT2AMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL7872779 0.85 KMT2A (0.81) KMT2AMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL237695 0.85 KMT2A (0.64) KMT2AMAPTRAB9ANPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5237034-A Preparation of siloxane modified polyimide resin CHEIL SYNTHETICS, INC. (KR) 1993-08-17 — — US disclosed
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