SCHEMBL11234733

SCHEMBL11234733

C=CCc1nc2cc(I)c(I)cc2[nH]1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.38
TP53 P04637 1/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 2/20 0.38
GAA P10253 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
HTT P42858 1/20 0.38
PSMD14 O00487 1/20 0.38
MMP2 P08253 1/20 0.38
ATM Q13315 1/20 0.38
CACNA1H O95180 2/20 0.35
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
F10 P00742 2/20 0.34
TPSAB1 Q15661 3/20 0.33
PRSS1 P07477 2/20 0.33
CACNA1G O43497 1/20 0.33
POLB P06746 1/20 0.33
F2 P00734 1/20 0.33
PLG P00747 1/20 0.33

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
SCHEMBL11229722 0.80 MAPT (0.36) MAPTTP53KMT2AMEN1GAA
SCHEMBL11231260 0.79 MAPT (0.38) MAPTTP53KMT2AMEN1GAA
SCHEMBL7769273 0.79 GAA (0.62) KMT2AMEN1GAATDP1HTT
SCHEMBL16838661 0.77 HTT (0.44) MAPTKMT2AMEN1GAATDP1
SCHEMBL253638 0.76 MAPT (0.37) MAPTTP53KMT2AMEN1GAA
SCHEMBL11228122 0.74 GAA (0.47) MAPTTP53KMT2AMEN1GAA
SCHEMBL3258004 0.73 MAPT (0.50) MAPTTP53KMT2AMEN1TDP1
SCHEMBL9426469 0.73 TDP1 (0.64) MAPTTP53KMT2AMEN1TDP1
SCHEMBL4563435 0.73 TDP1 (0.47) MAPTKMT2AMEN1GAATDP1
SCHEMBL9706307 0.73 IDO1 (0.45) MAPTTP53HTTCACNA1HALDH1A1

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-0088595-A2 Cyanine dyes for sensitizing silver halide emulsions to infrared radiation and photographic elements including them MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1983-09-14 EP disclosed