SCHEMBL28410189

SCHEMBL28410189

CC1=CC(N=Nc2cccc(C(C)(C)C)c2)C(O)([N+](=O)[O-])C=C1Cl

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HDAC4 P56524 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL28548316 0.90 HDAC4 (0.30) HDAC4HDAC2HDAC8
SCHEMBL28725270 0.82 MEN1 (0.32) NPC1RAB9AMEN1KMT2AHDAC4
SCHEMBL28548694 0.73 HDAC4 (0.30) HDAC4HDAC2HDAC8
SCHEMBL28408350 0.71 MEN1 (0.31) NPC1RAB9AMEN1KMT2A
SCHEMBL7085445 0.68 NPC1 (0.32) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL28408931 0.67 MEN1 (0.31) NPC1RAB9AMEN1KMT2A
SCHEMBL7086931 0.66 ALDH1A1 (0.33) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL28357160 0.66 MAPT (0.38) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL28410199 0.63 MEN1 (0.31) NPC1RAB9AMEN1KMT2A
SCHEMBL7085063 0.60

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-112538055-A Preparation method of benzotriazole ultraviolet absorbent 西安凯立新材料股份有限公司 2021-03-23 CN disclosed
CN-108148009-B Method for preparing benzotriazole ultraviolet absorbent by adopting catalytic hydrogen transfer method 天津利安隆新材料股份有限公司 2020-05-12 CN disclosed