SCHEMBL15764671

SCHEMBL15764671

Cc1nc2cc(NC(=O)c3ccc([N+](=O)[O-])cc3)ccc2[nH]1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.83
MAPT P10636 6/20 0.60
MMP2 P08253 3/20 0.60
MMP9 P14780 3/20 0.60
MMP8 P22894 3/20 0.60
MMP13 P45452 3/20 0.60
KMT2A Q03164 8/20 0.59
MEN1 O00255 7/20 0.59
POLB P06746 4/20 0.57
NPC1 O15118 6/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
ALDH1A1 P00352 1/20 0.52
MITF O75030 2/20 0.51
MAPK1 P28482 1/20 0.51
CASP3 P42574 2/20 0.51
CASP2 P42575 1/20 0.51
CASP7 P55210 1/20 0.51
CASP6 P55212 1/20 0.51
CASP8 Q14790 1/20 0.51
HTT P42858 1/20 0.50

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
SCHEMBL4325535 0.78 HSP90AA1 (0.50) RAB9AMAPTKMT2AMEN1POLB
SCHEMBL4328210 0.77 ALDH1A1 (0.58) RAB9AMAPTMMP2MMP9MMP8
SCHEMBL14381553 0.77 MMP2 (0.69) RAB9AMAPTMMP2MMP9MMP8
SCHEMBL271133 0.77 RAB9A (0.70) RAB9AMAPTKMT2AMEN1POLB
SCHEMBL8710971 0.77 RAB9A (0.80) RAB9AMAPTKMT2AMEN1POLB
SCHEMBL12109610 0.77 MAPT (0.57) RAB9AMAPTNPC1SMN1; SMN2ALDH1A1
SCHEMBL14381527 0.76 MMP2 (0.68) RAB9AMAPTMMP2MMP9MMP8
SCHEMBL14381566 0.76 MMP2 (0.68) RAB9AMAPTMMP2MMP9MMP8
SCHEMBL23898948 0.76 KMT2A (0.83) RAB9AMAPTKMT2AMEN1POLB
SCHEMBL8572381 0.76 KMT2A (0.83) RAB9AMAPTKMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150191701-A1 ENHANCERS OF INDUCED PLURIPOTENT STEM CELL REPROGRAMMING CITY OF HOPE 2015-07-09 US disclosed
US-8962322-B2 Enhancers of induced pluripotent stem cell reprogramming CITY OF HOPE 2015-02-24 US disclosed
US-20140154805-A1 ENHANCERS OF INDUCED PLURIPOTENT STEM CELL REPROGRAMMING CITY OF HOPE (US) 2014-06-05 US disclosed