SCHEMBL8772759

SCHEMBL8772759

BrCCc1noc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.54
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA3 P07451 1/20 0.54
CA4 P22748 1/20 0.54
CA6 P23280 1/20 0.54
MAOB P27338 1/20 0.54
CA5A P35218 1/20 0.54
CA7 P43166 1/20 0.54
CA9 Q16790 1/20 0.54
CA13 Q8N1Q1 1/20 0.54
CA14 Q9ULX7 1/20 0.54
CA5B Q9Y2D0 1/20 0.54
SMN1; SMN2 Q16637 6/20 0.49
CYP3A4 P08684 1/20 0.49
BLM P54132 1/20 0.49
ACHE P22303 2/20 0.46
RAB9A P51151 5/20 0.42
NPC1 O15118 4/20 0.42

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
SCHEMBL17241030 0.89 LMNA (0.51) LMNACA12CA1CA2CA3
SCHEMBL692195 0.84 LMNA (0.58) LMNACA12CA1CA2CA3
SCHEMBL29361971 0.84 LMNA (0.58) LMNACA12CA1CA2CA3
SCHEMBL3563801 0.81 LMNA (0.54) LMNACA12CA1CA2CA3
SCHEMBL31061939 0.81 LMNA (0.59) LMNACA12CA1CA2CA3
SCHEMBL6993416 0.81 LMNA (0.54) LMNACA12CA1CA2CA3
SCHEMBL12767421 0.81 LMNA (0.59) LMNACA12CA1CA2CA3
SCHEMBL1560932 0.81 LMNA (0.54) LMNACA12CA1CA2CA3
SCHEMBL6714180 0.81 LMNA (0.54) LMNACA12CA1CA2CA3
SCHEMBL5511869 0.78 LMNA (0.51) LMNACA12CA1CA2CA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024018403-A1 SUBSTITUTED IMIDAZOAMIDE COMPOUNDS, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2024-01-25 WO disclosed
EP-3140295-B1 HETEROCYCLYL-BUTANAMIDE DERIVATIVES MERCK PATENT GMBH (DE) 2018-09-12 EP disclosed
US-9809598-B2 Heterocyclyl-butanamide derivatives MERCK PATENT GMBH (DE) 2017-11-07 US disclosed
US-20170073347-A1 HETEROCYCLYL-BUTANAMIDE DERIVATIVES MERCK PATENT GMBH (DE) 2017-03-16 US disclosed
EP-3140295-A1 HETEROCYCLYL-BUTANAMIDE DERIVATIVES Merck Patent GmbH (DE) 2017-03-15 EP disclosed
CN-105399697-A Amino sulfonyl compound, preparation method and uses thereof SUZHOU WANGSHAN WANGSHUI BIOMEDICAL CO LTD 2016-03-16 CN disclosed
WO-2015169421-A1 HETEROCYCLYL-BUTANAMIDE DERIVATIVES MERCK PATENT GMBH (DE) 2015-11-12 WO disclosed
US-20150031686-A1 PHENYL-OXAZOLYL DERIVATIVES, PREPARATION METHOD THEREOF, AND RELATED APPLICATION OF THE PHENYL-OXAZOLYL DERIVATIVES AS AN IMPDH INHIBITOR INSTITUTE OF MEDICINAL BIOTECHNOLOGY, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2015-01-29 US disclosed
CN-103889976-A Indazole compounds, compositions and methods of use HOFFMANN LA ROCHE 2014-06-25 CN disclosed
EP-0789692-A1 BENZISOXAZOLE DERIVATIVES AND PESTICIDAL COMPOSITIONS CONTAINING THEM Novartis AG (CH) 1997-08-20 EP 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 (2 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-20150031686-A1 PHENYL-OXAZOLYL DERIVATIVES, PREPARATION METHOD THEREOF, AND RELATED APPLICATION OF THE PHENYL-OXAZOLYL DERIVATIVES AS AN IMPDH INHIBITOR IMPDH1, IMPDH2, IMPA1 LMNA 2857/4885CA12 4824/4885CA1 4356/4885
US-20170073347-A1 HETEROCYCLYL-BUTANAMIDE DERIVATIVES TNKS, TANK, TBKBP1 LMNA 1777/4885CA12 3887/4885CA1 1733/4885

“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.