SCHEMBL692483

SCHEMBL692483

O=C(O)C1=C(c2ccncc2)C(=O)N=N1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 2/20 0.42
ALDH1A1 P00352 3/20 0.39
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HSD17B10 Q99714 2/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 1/20 0.39
MAPK10 P53779 1/20 0.39
LMNA P02545 2/20 0.36
CDC7 O00311 2/20 0.36
DBF4 Q9UBU7 2/20 0.36
DHODH Q02127 1/20 0.36
NOTUM Q6P988 1/20 0.35
GAA P10253 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
P4HTM Q9NXG6 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HDAC1 Q13547 1/20 0.34

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
SCHEMBL692285 0.85 FGFR1 (0.43) NAPRTALDH1A1SMN1; SMN2LMNAL3MBTL1
SCHEMBL692332 0.81 TSHR (0.44) ALDH1A1SMN1; SMN2NPC1TP53RAB9A
SCHEMBL691310 0.76 POLB (0.39) ALDH1A1SMN1; SMN2HSD17B10LMNAKDM4E
SCHEMBL691425 0.76 CA2 (0.38) MEN1KMT2A
SCHEMBL691759 0.74 MCL1 (0.46) ALDH1A1MAPTSMN1; SMN2NPC1TP53
SCHEMBL10695376 0.70 FGFR1 (0.46) ALDH1A1MAPTSMN1; SMN2HSD17B10NPC1
SCHEMBL691486 0.69 RARB (0.35) ALDH1A1MAPTLMNADHODHL3MBTL1
SCHEMBL692376 0.67 KDM4E (0.45) ALDH1A1SMN1; SMN2NPC1RAB9AGAA
SCHEMBL692223 0.67 PDPK1 (0.38) ALDH1A1NPC1RAB9AKDR
SCHEMBL695537 0.66 RXRA (0.46) ALDH1A1SMN1; SMN2HSD17B10TP53RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2421501-A2 KERATIN DYEING COMPOSITIONS COMPRISING A RADICAL SCAVENGER AND USE THEREOF The Procter & Gamble Company (US) 2012-02-29 EP claimed
WO-2010123863-A2 KERATIN DYEING COMPOSITIONS COMPRISING A RADICAL SCAVENGER AND USE THEREOF THE PROCTER & GAMBLE COMPANY (US) 2010-10-28 WO claimed
EP-2421501-A2 KERATIN DYEING COMPOSITIONS COMPRISING A RADICAL SCAVENGER AND USE THEREOF The Procter & Gamble Company (US) 2012-02-29 EP disclosed
WO-2010123863-A2 KERATIN DYEING COMPOSITIONS COMPRISING A RADICAL SCAVENGER AND USE THEREOF THE PROCTER & GAMBLE COMPANY (US) 2010-10-28 WO disclosed