SCHEMBL3435582

SCHEMBL3435582

Nc1c(N=Nc2ccc([N+](=O)[O-])cc2)ccc2ccc(N=Nc3ccccc3[N+](=O)[O-])c(O)c12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
MAPT P10636 5/20 0.47
ALDH1A1 P00352 4/20 0.47
LMNA P02545 2/20 0.47
POLB P06746 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
HTT P42858 1/20 0.47
PKM P14618 1/20 0.41
MCL1 Q07820 1/20 0.41
ATM Q13315 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
CCNE2 O96020 2/20 0.41
CCNE1 P24864 2/20 0.41
CDK2 P24941 2/20 0.41
CCNT1 O60563 1/20 0.41
CCNB2 O95067 1/20 0.41
CDK1 P06493 1/20 0.41
CDK4 P11802 1/20 0.41
CCNB1 P14635 1/20 0.41

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
SCHEMBL3435541 0.90 MEN1 (0.51) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL31222686 0.90 MEN1 (0.51) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL3434070 0.90 ALDH1A1 (0.56) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL3201797 0.89 MEN1 (0.50) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL3434173 0.83 MEN1 (0.47) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL3433628 0.83 ALDH1A1 (0.49) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL3435585 0.82 ENPP2 (0.51) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL3434142 0.81 PTPN11 (0.50) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL3433610 0.80 MEN1 (0.48) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL3435549 0.78 SENP2 (0.51) MEN1KMT2AMAPTALDH1A1LMNA

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-8834620-B2 Black disazo dyes, their preparation and use ILFORD IMAGING SWITZERLAND GMBH (CH) 2014-09-16 US disclosed
US-20120090503-A1 BLACK DISAZO DYES, THEIR PREPARATION AND USE ILFORD IMAGING SWITZERLAND GMBH 2012-04-19 US disclosed