SCHEMBL7754869

SCHEMBL7754869

CS(=O)(=O)c1ccc2c(c1)C(=N)N=C2

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.35
G6PD P11413 1/20 0.35
IDE P14735 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ENPP2 Q13822 1/20 0.34
KIF11 P52732 1/20 0.34
PTGS2 P35354 7/20 0.33
LMNA P02545 1/20 0.33
PTGDR2 Q9Y5Y4 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
SCHEMBL5158566 0.68 ALDH1A1 (0.46) G6PDIDESMN1; SMN2ENPP2PTGS2
SCHEMBL17948135 0.65 PKM (0.53) BRD4G6PDIDESMN1; SMN2ENPP2
SCHEMBL27473342 0.63 MEN1 (0.40) BRD4G6PDIDESMN1; SMN2ENPP2
SCHEMBL758951 0.62 LMNA (0.64) G6PDIDESMN1; SMN2ENPP2PTGS2
SCHEMBL11685503 0.62 PTGS2 (0.39) BRD4G6PDIDESMN1; SMN2PTGS2
SCHEMBL2376239 0.62 ENPP2 (0.72) ENPP2PTGS2
SCHEMBL12508320 0.61 AKR1C3 (0.58) G6PDIDESMN1; SMN2ENPP2PTGS2
SCHEMBL16574199 0.61 PTGS2 (0.61) PTGS2PTGDR2
SCHEMBL7125518 0.61 PARG (0.59) SMN1; SMN2PTGS2LMNA
SCHEMBL13203351 0.60 AKR1C3 (0.52) G6PDIDESMN1; SMN2ENPP2PTGS2

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
EP-1073407-A1 HAIR DYEING METHOD USING AN ALIPHATIC CATIONIC AMINE AND A ALDEHYDE OR KETONE ORQUINONE OR DI-IMINO-ISOINDOLINE OR 3-AMINO-ISO-INDOLONE DERIVATIVES L'OREAL (FR) 2001-02-07 EP disclosed
WO-2000038640-A1 HAIR DYEING METHOD USING AN ALIPHATIC CATIONIC AMINE AND A ALDEHYDE OR KETONE OR QUINONE OR DI-IMINO-ISOINDOLINE OR 3-AMINO-ISO-INDOLONE DERIVATIVES L'OREAL (FR) 2000-07-06 WO disclosed