SCHEMBL8629697

SCHEMBL8629697

Sc1nc(S)nc(N2CCCC2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
USP2 O75604 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MAPK1 P28482 3/20 0.46
ALDH1A1 P00352 2/20 0.46
NPC1 O15118 1/20 0.46
GALR3 O60755 1/20 0.46
TP53 P04637 1/20 0.46
RAB9A P51151 1/20 0.46
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
HTT P42858 1/20 0.45
RECQL P46063 1/20 0.45
ATM Q13315 1/20 0.45
CYP2C19 P33261 3/20 0.42
LMNA P02545 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 2/20 0.42
CASP1 P29466 1/20 0.42

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
SCHEMBL10816947 0.97 SMN1; SMN2 (0.52) HRH1SMN1; SMN2USP2TDP1MAPK1
SCHEMBL29274357 0.95 HRH1 (0.56) HRH1SMN1; SMN2USP2TDP1MAPK1
SCHEMBL28625836 0.92 SMN1; SMN2 (0.58) HRH1SMN1; SMN2USP2TDP1MAPK1
SCHEMBL29274355 0.92 SMN1; SMN2 (0.58) HRH1SMN1; SMN2USP2TDP1MAPK1
SCHEMBL28640929 0.83 KDM4E (0.59) HRH1SMN1; SMN2USP2TDP1MAPK1
SCHEMBL28630449 0.81 ALDH1A1 (0.62) HRH1SMN1; SMN2USP2TDP1MAPK1
SCHEMBL1975340 0.80 HRH1 (0.70) HRH1SMN1; SMN2USP2TDP1MAPK1
SCHEMBL7619652 0.78 KDM4E (0.48) SMN1; SMN2MAPK1ALDH1A1MEN1KMT2A
SCHEMBL11208162 0.77 SMN1; SMN2 (0.71) HRH1SMN1; SMN2USP2TDP1MAPK1
SCHEMBL9730702 0.75 SMN1; SMN2 (0.68) HRH1SMN1; SMN2USP2TDP1MAPK1

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
EP-0508390-B1 Light-sensitive silver halide photographic material KONISHIROKU PHOTO IND (JP) 1998-07-01 EP disclosed
US-5258280-A 2-amino-4,6-dimercapto-1,3,5-triazine derivatives; blackness, high covering power KONICA CORPORATION (JP) 1993-11-02 US disclosed
EP-0508390-A2 Light-sensitive silver halide photographic material KONICA CORPORATION (JP) 1992-10-14 EP disclosed