SCHEMBL28117945

SCHEMBL28117945

C=CC(CCc1ccccc1)n1ccnc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP17A1 P05093 5/20 0.49
▸ CYP19A1 P11511 9/20 0.47
▸ CYP24A1 Q07973 1/20 0.44
▸ CYP3A4 P08684 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP11B1 P15538 1/20 0.41
▸ CYP11B2 P19099 1/20 0.41
▸ TBXAS1 P24557 1/20 0.41
▸ QPCT Q16769 1/20 0.41
▸ CYP4Z1 Q86W10 1/20 0.41
▸ QPCTL Q9NXS2 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ NR1I2 O75469 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ ABCB11 O95342 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ PLA2G1B P04054 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
SCHEMBL27905027 0.86 CYP19A1 (0.57) CYP17A1CYP19A1CYP24A1CYP3A4MAPT
Hydrochloric Acid SCHEMBL2421272 0.85 CYP19A1 (0.56) CYP17A1CYP19A1CYP24A1CYP3A4MAPT
SCHEMBL29283781 0.77 CYP19A1 (0.50) CYP17A1CYP19A1CYP24A1CYP3A4MAPT
SCHEMBL9996107 0.77 CYP19A1 (0.50) CYP17A1CYP19A1CYP24A1CYP3A4MAPT
SCHEMBL5305103 0.77 KDM4E (0.55) CYP17A1CYP19A1CYP24A1POLB
Hydrochloric Acid SCHEMBL9996046 0.76 CYP19A1 (0.49) CYP17A1CYP19A1CYP24A1CYP3A4MAPT
SCHEMBL5301494 0.75 CYP19A1 (0.55) CYP17A1CYP19A1CYP24A1CYP11B1CYP11B2
SCHEMBL5329705 0.75 CYP24A1 (0.48) CYP17A1CYP19A1CYP24A1CYP3A4MAPT
SCHEMBL27727132 0.74 CYP17A1 (0.43) CYP17A1CYP19A1TBXAS1
SCHEMBL28111930 0.74 CYP17A1 (0.39) CYP17A1CYP19A1

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-106390948-B A kind of grafting has silicon wafer of poly ion liquid and its preparation method and application 深圳市北测检测技术有限公司 2019-04-26 — — CN claimed
CN-106390948-A Silicon wafer grafted with polyionic liquid, preparation method and application thereof 深圳市北测检测技术有限公司 2017-02-15 — — CN claimed
CN-106390948-B A kind of grafting has silicon wafer of poly ion liquid and its preparation method and application 深圳市北测检测技术有限公司 2019-04-26 — — CN disclosed
CN-106390948-B A kind of grafting has silicon wafer of poly ion liquid and its preparation method and application 深圳市北测检测技术有限公司 2019-04-26 — — CN disclosed
CN-106390948-A Silicon wafer grafted with polyionic liquid, preparation method and application thereof 深圳市北测检测技术有限公司 2017-02-15 — — CN disclosed
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