SCHEMBL7700384

SCHEMBL7700384

COCCOCn1cc(SC(N)=O)c2c(N)ncnc21

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 2/20 0.39
FLT3 P36888 2/20 0.39
RET P07949 12/20 0.38
NT5E P21589 1/20 0.36
LCK P06239 1/20 0.35
SRC P12931 1/20 0.35
TEK Q02763 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
SCHEMBL10388753 0.89 SRC (0.41) ENPP1FLT3NT5ELCKSRC
SCHEMBL7700982 0.87 FLT3 (0.37) FLT3RETLCKSRCTEK
SCHEMBL7699597 0.86 ADK (0.35) ENPP1FLT3RET
SCHEMBL7699500 0.81 IGF1R (0.42) RETLCKSRCTEK
SCHEMBL8991287 0.80 FLT3 (0.40) ENPP1FLT3RETNT5ELCK
SCHEMBL7700383 0.78 NPC1 (0.43) ENPP1FLT3RETNT5ELCK
SCHEMBL8991281 0.78 ENPP1 (0.39) ENPP1FLT3RETNT5ELCK
SCHEMBL7703321 0.78 RET (0.38) ENPP1RETNT5E
SCHEMBL7705468 0.76 EGFR (0.43) LCKSRCTEK
SCHEMBL7701195 0.74 ADK (0.42) ENPP1RETNT5ELCKSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6342501-B1 VIRICIDES THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2002-01-29 US disclosed
US-5543413-A VIRAL ACTIVITY AGAINST HUMAN CYTOMEGALOVIRUS AND HERPES SIMPLEX VIRUS REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1996-08-06 US disclosed