SCHEMBL27832425

SCHEMBL27832425

O=C(NNc1ccccn1)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
LMNA P02545 3/20 0.50
MAPT P10636 7/20 0.49
NPC1 O15118 6/20 0.49
RAB9A P51151 6/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
STAT1 P42224 1/20 0.49
ALDH1A1 P00352 4/20 0.46
TP53 P04637 1/20 0.46
GAA P10253 3/20 0.46
MGLL Q99685 2/20 0.45
KDM4E B2RXH2 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
MITF O75030 1/20 0.44
PKM P14618 1/20 0.44

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
SCHEMBL2477935 0.87 NPC1 (0.57) MEN1KMT2ALMNAMAPTNPC1
SCHEMBL27716616 0.83 GAA (0.55) MEN1KMT2ALMNAMAPTNPC1
SCHEMBL17373926 0.79 MGLL (0.60) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL877775 0.76 KMT2A (0.65) MEN1KMT2ALMNAMAPTNPC1
SCHEMBL8701481 0.74 KMT2A (0.62) MEN1KMT2ALMNAMAPTNPC1
SCHEMBL6682458 0.74 KMT2A (0.58) MEN1KMT2ALMNAMAPTNPC1
SCHEMBL7401922 0.73 MAPT (0.49) MEN1KMT2ALMNAMAPTNPC1
SCHEMBL28406890 0.73 MAPT (0.49) MEN1KMT2ALMNAMAPTNPC1
SCHEMBL27668109 0.73 GAA (0.55) MEN1KMT2ALMNAMAPTNPC1
SCHEMBL28308932 0.72 ALOX5 (0.51) MEN1KMT2ALMNAMAPTNPC1

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
CN-102224139-B 4- (azacycloalkyl) benzene-1, 3-diol compounds as tyrosinase inhibitors, process for their preparation and their use in human medicine and cosmetics GALDERMA RES & DEV 2014-11-19 CN disclosed
CN-102224139-A Novel 4- (azacycloalkyl) benzene-1, 3-diol compounds as tyrosinase inhibitors, process for their preparation and their use in human medicine and cosmetics GALDERMA RES & DEV 2011-10-19 CN disclosed