SCHEMBL12444207

SCHEMBL12444207

CCc1ccc(/C=N/S(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.64
▸ POLB P06746 2/20 0.64
▸ CA2 P00918 3/20 0.49
▸ CA12 O43570 2/20 0.49
▸ CA9 Q16790 2/20 0.49
▸ CA1 P00915 1/20 0.49
▸ LMNA P02545 2/20 0.49
▸ GAA P10253 1/20 0.49
▸ KMT2A Q03164 3/20 0.47
▸ ATM Q13315 1/20 0.45
▸ PTGS2 P35354 2/20 0.44
▸ PTGS1 P23219 1/20 0.44
▸ HCRTR2 O43614 1/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ MEN1 O00255 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ F2 P00734 1/20 0.40
▸ PRSS1 P07477 1/20 0.40
▸ PRSS2 P07478 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
SCHEMBL10047304 1.00 ALDH1A1 (0.64) ALDH1A1POLBCA2CA12CA9
SCHEMBL29113394 0.89 ALDH1A1 (0.66) ALDH1A1POLBCA2CA12CA9
SCHEMBL29113399 0.89 ALDH1A1 (0.66) ALDH1A1POLBCA2CA12CA9
SCHEMBL16802983 0.88 ALDH1A1 (0.78) ALDH1A1POLBCA2CA12CA9
SCHEMBL307938 0.88 ALDH1A1 (0.78) ALDH1A1POLBCA2CA12CA9
SCHEMBL10073012 0.88 ALDH1A1 (0.78) ALDH1A1POLBCA2CA12CA9
SCHEMBL21939418 0.86 ALDH1A1 (0.55) ALDH1A1POLBCA2CA12CA9
SCHEMBL12516171 0.81 ALDH1A1 (0.68) ALDH1A1POLBCA2CA12CA9
SCHEMBL12444230 0.81 ALDH1A1 (0.68) ALDH1A1POLBCA2CA12CA9
SCHEMBL12444212 0.81 ALDH1A1 (0.68) ALDH1A1POLBCA2CA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10197557-B2 Small molecules for endothelial cell activation THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-02-05 — — US disclosed
US-8815935-B2 Inhibitors of protein prenyltransferases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-08-26 — — US disclosed
US-8815935-B2 Inhibitors of protein prenyltransferases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-08-26 — — US disclosed
US-20130310417-A1 Small Molecules For Endothelial Cell Activation THE REGENTS OF THE UNIVERSITY FO CALIFORNIA (US) 2013-11-21 — — US disclosed
US-20130102639-A1 INHIBITORS OF PROTEIN PRENYLTRANSFERASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-04-25 — — US disclosed
US-20130102639-A1 INHIBITORS OF PROTEIN PRENYLTRANSFERASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-04-25 — — US disclosed
WO-2012116181-A2 SMALL MOLECULES FOR ENDOTHELIAL CELL ACTIVATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-08-30 — — WO disclosed
US-20110178138-A1 INHIBITORS OF PROTEIN PRENYLTRANSFERASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-07-21 — — US disclosed
US-20110178138-A1 INHIBITORS OF PROTEIN PRENYLTRANSFERASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-07-21 — — 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 (4 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-20130102639-A1 INHIBITORS OF PROTEIN PRENYLTRANSFERASES RABGGTA, FNTA, RABGGTB ALDH1A1 2160/4885POLB 3212/4885CA2 4616/4885
US-20130310417-A1 Small Molecules For Endothelial Cell Activation LIPG, VCAM1, SELE ALDH1A1 3849/4885POLB 3434/4885CA2 1812/4885
US-10197557-B2 Small molecules for endothelial cell activation LIPG, VCAM1, SELE ALDH1A1 3849/4885POLB 3434/4885CA2 1812/4885
US-20110178138-A1 INHIBITORS OF PROTEIN PRENYLTRANSFERASES RABGGTA, FNTA, RABGGTB ALDH1A1 2160/4885POLB 3212/4885CA2 4616/4885

“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.

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