SCHEMBL29091824

SCHEMBL29091824

CCCCOc1cccc([SiH3])c1OCCCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.52
▸ CYP2C9 P11712 2/20 0.52
▸ CYP2C19 P33261 2/20 0.52
▸ CHRM2 P08172 2/20 0.49
▸ LMNA P02545 2/20 0.49
▸ CHRM1 P11229 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ ACHE P22303 1/20 0.49
▸ KCNH2 Q12809 1/20 0.49
▸ HIF1A Q16665 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ MCHR1 Q99705 3/20 0.45
▸ CYP19A1 P11511 1/20 0.41
▸ HTR1B P28222 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ LTA4H P09960 1/20 0.40

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
SCHEMBL1238407 0.88 LMNA (0.60) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL5032298 0.85 LMNA (0.43) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL19056885 0.82 CYP1A2 (0.53) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL27626736 0.82 CYP1A2 (0.62) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL19612454 0.81 SMN1; SMN2 (0.74) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL6709141 0.81 CYP1A2 (0.52) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL4527369 0.80 CHRM2 (0.56) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL453505 0.80 CHRM2 (0.56) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL19612412 0.80 SMN1; SMN2 (0.55) CYP1A2CYP2C9CYP2C19CHRM2LMNA
SCHEMBL30167843 0.80 CHRM2 (0.56) CYP1A2CYP2C9CYP2C19CHRM2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116710498-A Polyimide precursor resin composition and method for producing same 旭化成株式会社 2023-09-05 — — CN disclosed
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