SCHEMBL3439640

SCHEMBL3439640

CCOc1ccc(OCC)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.62
▸ ALDH1A1 P00352 7/20 0.62
▸ MEN1 O00255 4/20 0.62
▸ KMT2A Q03164 4/20 0.62
▸ KDM4E B2RXH2 4/20 0.62
▸ TDP1 Q9NUW8 3/20 0.62
▸ USP2 O75604 2/20 0.62
▸ DUSP3 P51452 1/20 0.62
▸ THRB P10828 2/20 0.61
▸ APAF1 O14727 2/20 0.61
▸ GAA P10253 1/20 0.61
▸ CASP1 P29466 1/20 0.61
▸ BRCA1 P38398 1/20 0.61
▸ CASP7 P55210 1/20 0.61
▸ PTPRC P08575 2/20 0.54
▸ CDC25B P30305 3/20 0.53
▸ TTR P02766 1/20 0.52
▸ RAB9A P51151 4/20 0.51
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ POLB P06746 2/20 0.51

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
SCHEMBL6906659 0.87 TTR (0.68) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL11210966 0.84 MAPT (0.56) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL28914178 0.83 SMN1; SMN2 (0.59) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL2920541 0.80 KCNA3 (0.55) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL29435077 0.80 MAPT (0.58) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL12582010 0.80 MAPT (0.58) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL13998834 0.80 MAPT (0.57) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL19341712 0.79 ELANE (0.50) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL3420371 0.79 CDC25B (0.60) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL5105541 0.78 MAPT (0.55) MAPTALDH1A1MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108059689-B Olefin polymerization procatalyst composition, process for producing the same, and olefin polymerization catalyst composition 中国石油天然气股份有限公司 2020-05-08 — — CN disclosed
US-7807340-B2 Photoresists for visible light imaging INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2010-10-05 — — US disclosed
US-20080166669-A1 Photoresists for Visible Light Imaging INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2008-07-10 — — US disclosed
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