SCHEMBL29684233

SCHEMBL29684233

CCCCCOc1cc(Cl)ccc1N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
RAB9A P51151 1/20 0.46
KCNA3 P22001 1/20 0.45
BCHE P06276 2/20 0.45
ACHE P22303 2/20 0.45
ALDH1A1 P00352 4/20 0.44
MAPT P10636 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
KDM4E B2RXH2 2/20 0.44
MEN1 O00255 2/20 0.44
POLB P06746 2/20 0.44
KMT2A Q03164 2/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TLR8 Q9NR97 2/20 0.44
TSHR P16473 3/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL3785269 0.95 CYP1A2 (0.58) CYP1A2CYP2C9CYP2C19RAB9ABCHE
SCHEMBL3784669 0.89 MAPT (0.51) CYP1A2CYP2C9CYP2C19BCHEACHE
SCHEMBL8263900 0.83 LMNA (0.48) CYP1A2CYP2C9CYP2C19RAB9AALDH1A1
SCHEMBL9621578 0.82 ALDH1A1 (0.67) CYP1A2CYP2C9CYP2C19BCHEACHE
SCHEMBL315662 0.82 ALDH1A1 (0.66) RAB9AALDH1A1MAPTL3MBTL1KDM4E
SCHEMBL368123 0.81 TSHR (0.56) CYP1A2CYP2C9CYP2C19RAB9ABCHE
SCHEMBL15716191 0.81 HTR2C (0.49) ALDH1A1MAPTL3MBTL1KDM4EMEN1
SCHEMBL17240308 0.81 TSHR (0.56) CYP1A2CYP2C9CYP2C19RAB9ABCHE
SCHEMBL22773397 0.81 TSHR (0.56) CYP1A2CYP2C9CYP2C19RAB9ABCHE
SCHEMBL351594 0.81 TSHR (0.56) CYP1A2CYP2C9CYP2C19RAB9ABCHE

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-114763346-B Compounds for inducing cartilage formation and application thereof 华东师范大学 2025-06-10 CN disclosed
CN-114763346-A Compound for inducing chondrogenesis and application thereof 华东师范大学 2022-07-19 CN disclosed