SCHEMBL21633775

SCHEMBL21633775

CCC(C)(C)c1ccc(C[O])cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
MAPT P10636 1/20 0.46
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
CASP3 P42574 1/20 0.43
ATM Q13315 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
ESR1 P03372 2/20 0.42
ESR2 Q92731 2/20 0.42
ADORA3 P0DMS8 1/20 0.39
CHRM1 P11229 1/20 0.39
DRD3 P35462 1/20 0.39
KCNH2 Q12809 1/20 0.39
POLB P06746 1/20 0.38
CYP2C9 P11712 1/20 0.38
CNR2 P34972 2/20 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
SCHEMBL779443 0.83 NPC1 (0.58) NPC1RAB9AMAPTLMNAMAPK1
SCHEMBL14479518 0.82 NPC1 (0.46) NPC1RAB9AMAPTLMNAMAPK1
SCHEMBL11539224 0.81 NPC1 (0.48) NPC1RAB9AMAPTLMNAMAPK1
SCHEMBL21633797 0.80 SHBG (0.57) MAPTLMNAMAPK1SMN1; SMN2ESR1
SCHEMBL26382768 0.78 NPC1 (0.43) NPC1RAB9AMAPTLMNAMAPK1
SCHEMBL13016 0.78 NPC1 (0.50) NPC1RAB9AMAPTLMNAMAPK1
SCHEMBL1006929 0.78 TSHR (0.50) LMNAKCNH2POLBTP53TSHR
SCHEMBL5750563 0.77 ESR1 (0.47) NPC1RAB9AMAPTLMNAMAPK1
SCHEMBL6299448 0.77 NPC1 (0.46) NPC1RAB9AMAPTLMNAMAPK1
SCHEMBL4447195 0.77 NPC1 (0.46) NPC1RAB9AMAPTLMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111315828-B Composition, cured product, optical filter, and method for producing cured product 株式会社艾迪科 2023-09-29 CN disclosed
CN-112154167-B Composition, cured product, optical filter, and method for producing cured product 株式会社艾迪科 2023-08-22 CN disclosed
CN-112154167-A Composition, cured product, optical filter, and method for producing cured product 株式会社艾迪科 2020-12-29 CN disclosed
CN-111315828-A Composition, cured product, optical filter, and method for producing cured product 株式会社艾迪科 2020-06-19 CN disclosed
WO-2020021969-A1 COMPOSITION, CURED PRODUCT, OPTICAL FILTER, AND PRODUCTION METHOD FOR CURED PRODUCT 株式会社ADEKA 2020-01-30 WO disclosed