SCHEMBL9634193

SCHEMBL9634193

CCc1ccc(NC2=CCC(=[N+]=[N-])C=C2OP(=O)(O)O)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.36
APAF1 O14727 3/20 0.34
MITF O75030 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP2C19 P33261 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 2/20 0.33
NPC1 O15118 2/20 0.33
HSP90AA1 P07900 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.33
RAB9A P51151 1/20 0.33
GALK1 P51570 1/20 0.32
BLM P54132 1/20 0.32
HKDC1 Q2TB90 1/20 0.32
XBP1 P17861 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
S1PR1 P21453 1/20 0.30
S1PR3 Q99500 1/20 0.30

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
SCHEMBL9633587 0.67
SCHEMBL9633538 0.65
SCHEMBL9633980 0.64 MEN1 (0.32) MEN1KMT2A
SCHEMBL9632707 0.63 RAB9A (0.36) TDP1SMN1; SMN2MEN1NPC1KMT2A
SCHEMBL9633954 0.63 S1PR1 (0.32) S1PR1S1PR3
Sulfuric Acid SCHEMBL8388343 0.61 SRC (0.35) SRCBLM
SCHEMBL1101448 0.61 CYP2C19 (0.72) SRCCYP2C19SMN1; SMN2POLBBLM
SCHEMBL9633549 0.60 GRIN2D (0.32)
Hydrochloric Acid SCHEMBL28980283 0.60 CYP2C19 (0.70) SRCCYP2C19SMN1; SMN2POLBBLM
SCHEMBL27375427 0.60 CYP2C19 (0.70) SRCCYP2C19SMN1; SMN2POLBBLM

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
EP-0487343-A1 Process for preparing a lithographic plate Fuji Photo Film Co., Ltd. (JP) 1992-05-27 EP disclosed