SCHEMBL10246306

SCHEMBL10246306

CC(C)(C)Cc1cnc(Br)s1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
RAB9A P51151 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL27213267 0.83
SCHEMBL21325317 0.80 RAB9A (0.32) LMNAPOLBRAB9AATML3MBTL1
SCHEMBL1911594 0.80 SLC6A3 (0.40) LMNAPOLBRAB9AATML3MBTL1
SCHEMBL4548402 0.79 PDK1 (0.33)
SCHEMBL1912687 0.78 L3MBTL1 (0.49) LMNAPOLBRAB9AATML3MBTL1
SCHEMBL13010776 0.77 LMNA (0.30) LMNAPOLBRAB9AATML3MBTL1
SCHEMBL11922170 0.77 SLC6A3 (0.45) LMNAPOLBRAB9AATML3MBTL1
SCHEMBL3072164 0.75
SCHEMBL4548405 0.74 SMN1; SMN2 (0.43) LMNA
SCHEMBL1911586 0.74

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-9314025-B2 Mixtures of mesoionic pesticides E I DU PONT DE NEMOURS AND COMPANY (US) 2016-04-19 US disclosed
US-9018220-B2 Mesoionic pesticides E I DU PONT DE NEMOURS AND COMPANY (US) 2015-04-28 US disclosed
US-20140187776-A1 MIXTURES OF MESOIONIC PESTICIDES E I DU PONT DE NEMOURS AND COMPANY (US) 2014-07-03 US disclosed
US-8552007-B2 Mesoionic pesticides E.I. DU PONT DE NEMOURS AND COMPANY (US) 2013-10-08 US disclosed
US-20120115722-A1 MIXTURES OF MESOIONIC PESTICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-05-10 US disclosed
US-20100323887-A1 MESOIONIC PESTICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-12-23 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 (3 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-20140187776-A1 MIXTURES OF MESOIONIC PESTICIDES DDT, C5, CBR3 LMNA 2556/4885POLB 4120/4885RAB9A 2436/4885
US-20100323887-A1 MESOIONIC PESTICIDES DDT, CHRM1, CHRM3 LMNA 4228/4885POLB 4546/4885RAB9A 888/4885
US-20120115722-A1 MIXTURES OF MESOIONIC PESTICIDES DDT, C5, CBR3 LMNA 2556/4885POLB 4120/4885RAB9A 2436/4885

“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.