SCHEMBL16117348

SCHEMBL16117348

Cc1nc(C)nc(-c2ccc(Cl)cc2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
L3MBTL1 Q9Y468 1/20 0.54
NR1H4 Q96RI1 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 1/20 0.46
PKM P14618 1/20 0.46
NR1H3 Q13133 2/20 0.46
NR1H2 P55055 1/20 0.46
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
TP53 P04637 1/20 0.43
NPSR1 Q6W5P4 2/20 0.42
ADORA3 P0DMS8 2/20 0.42
RPA1 P27694 1/20 0.42
HTR2A P28223 1/20 0.41

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
SCHEMBL14596618 0.85 L3MBTL1 (0.64) NPC1RAB9AL3MBTL1MEN1KMT2A
SCHEMBL11941643 0.82 NPC1 (0.44) NPC1RAB9AL3MBTL1NR1H4MEN1
SCHEMBL9869365 0.82 NPC1 (0.68) NPC1RAB9AL3MBTL1NR1H4MEN1
SCHEMBL18015606 0.81 KDM1A (0.43) NPC1RAB9AL3MBTL1MEN1KMT2A
SCHEMBL23624497 0.81 NR1H4 (0.63) NPC1RAB9ANR1H4MEN1KMT2A
SCHEMBL12440881 0.80 L3MBTL1 (0.58) NPC1RAB9AL3MBTL1NR1H4MEN1
SCHEMBL17269507 0.79 NPC1 (0.65) NPC1RAB9AL3MBTL1NR1H4MEN1
SCHEMBL14374410 0.79 NPC1 (0.65) NPC1RAB9AL3MBTL1NR1H4MEN1
SCHEMBL3155930 0.79 NPC1 (0.54) NPC1RAB9ANR1H4MEN1KMT2A
SCHEMBL16189472 0.79 LMNA (0.57) NPC1RAB9ANR1H4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115010673-B Method for synthesizing 1,3, 5-triazine compounds under visible light-induced metal-free catalysis condition 河南大学 2024-01-30 CN disclosed
CN-115010673-A Method for synthesizing 1,3,5-triazine compound under visible light induction and metal-free catalysis condition 河南大学 2022-09-06 CN disclosed
US-20140283702-A1 LITHOGRAPHIC PRINTING PLATE SUPPORT AND NEGATIVE PHOTOSENSITIVE LITHOGRAPHIC PRINTING PLATE MITSUBISHI PAPER MILLS LIMITED (JP) 2014-09-25 US disclosed