SCHEMBL3012002

SCHEMBL3012002

CC(C)(C)c1cc(C=NCCN=Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1.[Co]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.50
PTGS2 P35354 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
KMT2A Q03164 1/20 0.44
HTT P42858 1/20 0.41
HIF1A Q16665 6/20 0.40
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
ALOX12 P18054 1/20 0.38
MAPT P10636 1/20 0.38
HSP90AA1 P07900 1/20 0.38
CA1 P00915 1/20 0.37

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
SCHEMBL3998710 0.98 ALOX5 (0.51) ALOX5PTGS2SMN1; SMN2KDM4EMEN1
SCHEMBL29785796 0.98 ALOX5 (0.51) ALOX5PTGS2SMN1; SMN2KDM4EMEN1
SCHEMBL3998711 0.98 ALOX5 (0.51) ALOX5PTGS2SMN1; SMN2KDM4EMEN1
SCHEMBL29535850 0.98 ALOX5 (0.51) ALOX5PTGS2SMN1; SMN2KDM4EMEN1
SCHEMBL6533683 0.97 ALOX5 (0.50) ALOX5PTGS2SMN1; SMN2KDM4EMEN1
Hydrochloric Acid SCHEMBL6531105 0.95 ALOX5 (0.49) ALOX5PTGS2SMN1; SMN2KDM4EMEN1
Hydrochloric Acid SCHEMBL30839924 0.95 ALOX5 (0.50) ALOX5PTGS2SMN1; SMN2KDM4EMEN1
Bromide SCHEMBL3016844 0.95 ALOX5 (0.49) ALOX5PTGS2SMN1; SMN2KDM4EMEN1
SCHEMBL3016845 0.92 ALOX5 (0.47) ALOX5PTGS2SMN1; SMN2KDM4EMEN1
SCHEMBL13321375 0.92 ALOX5 (0.49) ALOX5PTGS2SMN1; SMN2KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8278239-B2 Polycarbonates made using highly selective catalysts CORNELL RESEARCH FOUNDATION, INC. (US) 2012-10-02 US disclosed
US-20100204437-A1 POLYCARBONATES MADE USING HIGHLY SELECTIVE CATALYSTS CORNELL RESEARCH FOUNDATION, INC. (US) 2010-08-12 US disclosed
US-7723256-B2 Polycarbonates made using highly selective catalysts CORNELL RESEARCH FOUNDATION, INC. (US) 2010-05-25 US disclosed
US-7674873-B2 Polycarbonates made using highly selective catalysts CORNELL RESEARCH FOUNDATION, INC. (US) 2010-03-09 US disclosed
US-20080108499-A1 Polycarbonates made using highly selective catalysts CORNELL RESEARCH FOUNDATION INC. (US) 2008-05-08 US disclosed
US-7304172-B2 Polycarbonates made using highly selective catalysts CORNELL RESEARCH FOUNDATION, INC. (US) 2007-12-04 US disclosed
US-20070255039-A1 Polycarbonates made using highly selective catalysts CORNELL RESEARCH FOUNDATION, INC. (US) 2007-11-01 US disclosed
US-20060089252-A1 Polycarbonates made using highly selective catalysts CORNELL RESEARCH FOUNDATION, INC. (US) 2006-04-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100204437-A1 POLYCARBONATES MADE USING HIGHLY SELECTIVE CATALYSTS POF1B, PUF60, PARN ALOX5 2221/4885PTGS2 1897/4885SMN1; SMN2 3898/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.