SCHEMBL17084274

SCHEMBL17084274

CC(C)c1ccccc1/C=N/c1ccc(/N=C/c2ccccc2C(C)C)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 1/20 0.52
▸ CA1 P00915 4/20 0.44
▸ CA2 P00918 4/20 0.44
▸ CA9 Q16790 3/20 0.44
▸ CA7 P43166 1/20 0.44
▸ MAPT P10636 4/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ CYP1A2 P05177 2/20 0.43
▸ CYP3A4 P08684 2/20 0.43
▸ HIF1A Q16665 2/20 0.43
▸ THRB P10828 2/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ LMNA P02545 3/20 0.40
▸ GABRA1 P14867 2/20 0.40
▸ GABRB2 P47870 2/20 0.40
▸ CA12 O43570 2/20 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
SCHEMBL23907113 0.94 SIRT2 (0.46) SIRT2CA1CA2CA9CA7
SCHEMBL20953490 0.93 PTGS2 (0.49) SIRT2CA1CA2CA9CA7
SCHEMBL1879712 0.82 GAA (0.53) CYP1A2CYP2C9CYP2C19LMNAALDH1A1
SCHEMBL22130540 0.79 GABRA1 (0.41) CA1CA2MAPTKMT2ACYP1A2
SCHEMBL3956144 0.78 GABRA1 (0.48) CA1CA2CA9MAPTKMT2A
SCHEMBL27805712 0.78 SIRT2 (0.46) SIRT2CA1CA2CA9MAPT
SCHEMBL14931402 0.78 GABRA1 (0.45) CA1CA2MAPTKMT2ACYP1A2
SCHEMBL14931403 0.78 GABRA1 (0.45) CA1CA2MAPTKMT2ACYP1A2
SCHEMBL15614321 0.74 ADRA2A (0.43) CA1CA2MAPTKMT2ACYP1A2
SCHEMBL30139906 0.73 MAPT (0.54) SIRT2CA1CA2CA9MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170237119-A1 LI-ION ELECTROLYTE MEMBRANE FACILITATED BY A SELF-HEALING POLYMER MATRIX, AND ASSOCIATED BATTERY UNIV COLORADO REGENTS (US) 2017-08-17 — — US disclosed
US-20170237119-A1 LI-ION ELECTROLYTE MEMBRANE FACILITATED BY A SELF-HEALING POLYMER MATRIX, AND ASSOCIATED BATTERY UNIV COLORADO REGENTS (US) 2017-08-17 — — US disclosed
US-9453099-B2 Covalently cross-linked malleable polymers and methods of use THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2016-09-27 — — US disclosed
US-9453099-B2 Covalently cross-linked malleable polymers and methods of use THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2016-09-27 — — US disclosed
US-20150259458-A1 NOVEL COVALENTLY CROSS-LINKED MALLEABLE POLYMERS AND METHODS OF USE THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE 2015-09-17 — — US disclosed
US-20150259458-A1 NOVEL COVALENTLY CROSS-LINKED MALLEABLE POLYMERS AND METHODS OF USE THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE 2015-09-17 — — US disclosed
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