SCHEMBL7879019

SCHEMBL7879019

O=C(Cl)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.71
MEN1 O00255 8/20 0.71
RAB9A P51151 4/20 0.71
NPC1 O15118 3/20 0.71
MITF O75030 2/20 0.71
POLB P06746 2/20 0.71
ALDH1A1 P00352 2/20 0.71
MAPT P10636 8/20 0.65
MAPK1 P28482 2/20 0.65
HTT P42858 1/20 0.63
ATM Q13315 1/20 0.62
SMN1; SMN2 Q16637 3/20 0.59
P4HTM Q9NXG6 1/20 0.58
LMNA P02545 3/20 0.58
PSMB5 P28074 1/20 0.57
CYP11B1 P15538 1/20 0.57
CYP11B2 P19099 1/20 0.57

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
SCHEMBL8572381 0.92 KMT2A (0.83) KMT2AMEN1RAB9ANPC1MITF
SCHEMBL9134339 0.92 KMT2A (0.83) KMT2AMEN1RAB9ANPC1MITF
SCHEMBL23898948 0.92 KMT2A (0.83) KMT2AMEN1RAB9ANPC1MITF
SCHEMBL10940496 0.87 KMT2A (0.71) KMT2AMEN1RAB9ANPC1MITF
SCHEMBL7372420 0.87 KMT2A (0.71) KMT2AMEN1RAB9ANPC1MITF
SCHEMBL16367722 0.87 KMT2A (0.76) KMT2AMEN1RAB9ANPC1MITF
SCHEMBL24213121 0.87 KMT2A (0.76) KMT2AMEN1RAB9ANPC1MITF
SCHEMBL7881346 0.85 KMT2A (0.79) KMT2AMEN1RAB9ANPC1MITF
SCHEMBL7696438 0.85 KMT2A (0.79) KMT2AMEN1RAB9ANPC1MITF
SCHEMBL674700 0.85 KMT2A (0.73) KMT2AMEN1RAB9ANPC1MITF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115925577-A Novel diamines, polymers and films made therefrom SK新技术株式会社 2023-04-07 CN disclosed
US-6187285-B1 IN PARTICULAR MAGNETIC RESONANCE IMAGING (MRI) FOR MAGNETIC CATIONS. GUERBET (FR) 2001-02-13 US disclosed
US-4001218-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-01-04 US disclosed
US-3982011-A ANTIBIOTICS, ANIMAL GROWTH PROMOTERS BAYER AKTIENGESELLSCHAFT (DT) 1976-09-21 US disclosed
US-3931153-A BACTERICIDE BAYER AKTIENGESELLSCHAFT (DT) 1976-01-06 US disclosed