SCHEMBL29636784

SCHEMBL29636784

CCc1ccc(O)c(-n2nc3ccccc3n2)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.64
RAB9A P51151 4/20 0.64
LMNA P02545 1/20 0.64
TRPA1 O75762 1/20 0.47
KDM4E B2RXH2 5/20 0.42
POLB P06746 4/20 0.40
ALDH1A1 P00352 3/20 0.39
ALOX15 P16050 2/20 0.39
HSD17B10 Q99714 2/20 0.39
MAPT P10636 2/20 0.39
USP2 O75604 1/20 0.39
GAA P10253 1/20 0.39
ALOX12 P18054 1/20 0.39
HTT P42858 1/20 0.39
HPGD P15428 2/20 0.38
MAPK1 P28482 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38

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
SCHEMBL940379 1.00 NPC1 (0.64) NPC1RAB9ALMNATRPA1KDM4E
SCHEMBL29636761 0.88 NPC1 (0.60) NPC1RAB9ALMNAKDM4EPOLB
SCHEMBL10617263 0.88 NPC1 (0.60) NPC1RAB9ALMNAKDM4EPOLB
SCHEMBL11892463 0.87 RAB9A (0.63) NPC1RAB9ALMNAKDM4EPOLB
SCHEMBL76414 0.85 NPC1 (0.61) NPC1RAB9ALMNAKDM4EPOLB
SCHEMBL30240912 0.85 NPC1 (0.61) NPC1RAB9ALMNAKDM4EPOLB
SCHEMBL13700392 0.85 NPC1 (0.47) NPC1RAB9ALMNATRPA1KDM4E
SCHEMBL29431672 0.85 NPC1 (0.57) NPC1RAB9ALMNAKDM4EPOLB
SCHEMBL429864 0.85 NPC1 (0.57) NPC1RAB9ALMNAKDM4EPOLB
SCHEMBL10892228 0.84 NPC1 (0.49) NPC1RAB9ALMNATRPA1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116761871-A Method for producing base oils with enhanced color stability 雪佛龙美国公司 2023-09-15 CN claimed
CN-119768146-A Adhesive composition for dental use 可乐丽则武齿科株式会社 2025-04-04 CN disclosed
CN-118946340-A Curable composition for dentistry having excellent color tone adaptability 可乐丽则武齿科株式会社 2024-11-12 CN disclosed
CN-116761871-A Method for producing base oils with enhanced color stability 雪佛龙美国公司 2023-09-15 CN disclosed
CN-116367806-A Curable composition for dentistry having excellent color tone adaptability 可乐丽则武齿科株式会社 2023-06-30 CN disclosed
WO-2022092193-A1 DENTAL CURABLE COMPOSITION HAVING GOOD COLOR COMPATIBILITY クラレノリタケデンタル株式会社 2022-05-05 WO disclosed