SCHEMBL9769422

SCHEMBL9769422

CCOC(=O)c1ncnc(C(Cl)(Cl)Cl)n1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.48
LMNA P02545 1/20 0.48
PKM P14618 1/20 0.48
CYP1A2 P05177 1/20 0.40
KMT2A Q03164 2/20 0.39
NPC1 O15118 3/20 0.37
MAPT P10636 3/20 0.37
RAB9A P51151 2/20 0.37
HSD17B10 Q99714 2/20 0.37
ALDH1A1 P00352 2/20 0.37
TP53 P04637 1/20 0.37
XBP1 P17861 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TLR9 Q9NR96 1/20 0.37
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.36
MEN1 O00255 1/20 0.35

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
SCHEMBL4921789 0.72 CYP1A2 (0.46) KDM4ELMNACYP1A2KMT2AALDH1A1
SCHEMBL4921787 0.70 CYP1A2 (0.41) KDM4ELMNACYP1A2KMT2AALDH1A1
SCHEMBL352579 0.69 CYP1A2 (0.54) KDM4ECYP1A2KMT2ANPC1MAPT
SCHEMBL16796251 0.68 KMT2A (0.47) KDM4ECYP1A2KMT2ANPC1MAPT
SCHEMBL12396913 0.67 CYP1A2 (0.49) KDM4ELMNACYP1A2KMT2ANPC1
SCHEMBL124262 0.67 CA12 (0.50) KDM4ELMNAPKMCYP1A2KMT2A
SCHEMBL31084629 0.67 PDE4D (0.44) KDM4ELMNAPKMCYP1A2KMT2A
SCHEMBL463064 0.67 KDM4E (0.42) KDM4ELMNAPKMCYP1A2KMT2A
SCHEMBL489524 0.66 TSHR (0.52) KDM4ELMNACYP1A2NPC1RAB9A
SCHEMBL978908 0.66

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-5057398-A Improved photosensitivity HOECHST AKTIENGESELLSCHAFT (DE) 1991-10-15 US disclosed