SCHEMBL9099237

SCHEMBL9099237

CC(C)(C)C1CCC(OS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
ACHE P22303 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
HTT P42858 1/20 0.40
RECQL P46063 1/20 0.40
CA12 O43570 3/20 0.40
CA1 P00915 3/20 0.40
CA2 P00918 3/20 0.40
CA3 P07451 3/20 0.40
CA4 P22748 3/20 0.40
CA6 P23280 3/20 0.40
CA5A P35218 3/20 0.40
CA7 P43166 3/20 0.40
CA9 Q16790 3/20 0.40
CA13 Q8N1Q1 3/20 0.40
CA14 Q9ULX7 3/20 0.40
CA5B Q9Y2D0 3/20 0.40
CYP2D6 P10635 1/20 0.39
HSD11B1 P28845 4/20 0.39

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
SCHEMBL19469376 0.88 CA1 (0.48) ACHESMN1; SMN2HTTRECQLCA12
SCHEMBL8415137 0.86 PRMT5 (0.50) ACHESMN1; SMN2HTTCA1CA2
SCHEMBL8415133 0.86 PRMT5 (0.50) ACHESMN1; SMN2HTTCA1CA2
SCHEMBL20086099 0.84 ACHE (0.44) ACHESMN1; SMN2HTTRECQLCA12
SCHEMBL20086100 0.84 ACHE (0.44) ACHESMN1; SMN2HTTRECQLCA12
SCHEMBL3391969 0.82 CYP3A4 (0.57) CYP3A4CYP2C19ACHESMN1; SMN2HTT
SCHEMBL4411763 0.82 CYP3A4 (0.57) CYP3A4CYP2C19ACHESMN1; SMN2HTT
SCHEMBL4411239 0.82 CYP3A4 (0.57) CYP3A4CYP2C19ACHESMN1; SMN2HTT
SCHEMBL28310506 0.82 ACHE (0.43) ACHESMN1; SMN2HTTRECQLCA12
SCHEMBL20086128 0.82 ACHE (0.43) ACHESMN1; SMN2HTTRECQLCA12

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-11450445-B2 Electroconductive film and method for manufacturing electroconductive pattern TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2022-09-20 US disclosed
US-20200303086-A1 ELECTROCONDUCTIVE FILM AND METHOD FOR MANUFACTURING ELECTROCONDUCTIVE PATTERN TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2020-09-24 US disclosed
US-10720259-B2 Electroconductive film and method for manufacturing electroconductive pattern TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2020-07-21 US disclosed
US-20170309363-A1 ELECTROCONDUCTIVE FILM AND METHOD FOR MANUFACTURING ELECTROCONDUCTIVE PATTERN TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2017-10-26 US disclosed
US-5489501-A MIXTURES OF TWO COORDINATION COMPOUNDS WHICH REACT TO FORM NEW COORDINATION COMPOUND WHILE CAUSING VISIBLE COLOR CHANGES RICOH COMPANY, LTD. (JP) 1996-02-06 US disclosed
US-5446011-A Imagewise coloring when heating; mixture of n-substituted indole, aromatic polyhydroxy compound, carbonyl compound and an acid RICOH COMPANY, LTD. (JP) 1995-08-29 US disclosed