SCHEMBL1394992

SCHEMBL1394992

CN1CCC(N2CC[CH]CC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.41
L3MBTL3 Q96JM7 4/20 0.41
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.36
GAA P10253 1/20 0.36
ALOX15 P16050 2/20 0.35
NCF1 P14598 1/20 0.34
KDM1A O60341 1/20 0.33
HRH3 Q9Y5N1 1/20 0.32
MBTD1 Q05BQ5 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
SCHEMBL4537842 0.86 ALDH1A1 (0.33) L3MBTL1L3MBTL3ALDH1A1SMN1; SMN2GAA
SCHEMBL4537249 0.86 ALDH1A1 (0.37) L3MBTL1L3MBTL3ALDH1A1SMN1; SMN2GAA
SCHEMBL26042916 0.82 L3MBTL3 (0.47) L3MBTL1L3MBTL3ALDH1A1SMN1; SMN2GAA
SCHEMBL574979 0.82
SCHEMBL302125 0.81 L3MBTL1 (0.38) L3MBTL1L3MBTL3ALDH1A1HRH3
SCHEMBL3436969 0.79 L3MBTL1 (0.46) L3MBTL1L3MBTL3ALDH1A1SMN1; SMN2GAA
SCHEMBL12772837 0.79 L3MBTL3 (0.46) L3MBTL1L3MBTL3ALDH1A1SMN1; SMN2GAA
SCHEMBL15806955 0.78 ALDH1A1 (0.40) L3MBTL1L3MBTL3ALDH1A1SMN1; SMN2GAA
SCHEMBL4534766 0.78 ALDH1A1 (0.40) L3MBTL1L3MBTL3ALDH1A1SMN1; SMN2GAA
SCHEMBL4542912 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3423446-B1 NEW 2-SUBSTITUTED INDAZOLES, METHODS FOR PRODUCING SAME, PHARMACEUTICAL PREPARATIONS THAT CONTAIN SAME, AND USE OF SAME TO PRODUCE DRUGS Bayer Pharma AG (DE) 2020-09-16 EP claimed
US-10435396-B2 2-substituted indazoles, methods for producing same, pharmaceutical preparations that contain same, and use of same to produce drugs BAYER PHARMA AKTIEGESELLSCHAFT (DE) 2019-10-08 US claimed
US-20190071432-A1 NEW 2-SUBSTITUTED INDAZOLES, METHODS FOR PRODUCING SAME, PHARMACEUTICAL PREPARATIONS THAT CONTAIN SAME, AND USE OF SAME TO PRODUCE DRUGS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-03-07 US claimed
WO-2015028989-A1 NOVEL HETEROCYCLIC COMPOUNDS AS ANTIMALARIAL AGENTS ACTELION PHARMACEUTICALS LTD (CH) 2015-03-05 WO claimed
EP-3423446-B1 NEW 2-SUBSTITUTED INDAZOLES, METHODS FOR PRODUCING SAME, PHARMACEUTICAL PREPARATIONS THAT CONTAIN SAME, AND USE OF SAME TO PRODUCE DRUGS Bayer Pharma AG (DE) 2020-09-16 EP disclosed
US-10435396-B2 2-substituted indazoles, methods for producing same, pharmaceutical preparations that contain same, and use of same to produce drugs BAYER PHARMA AKTIEGESELLSCHAFT (DE) 2019-10-08 US disclosed
US-20190071432-A1 NEW 2-SUBSTITUTED INDAZOLES, METHODS FOR PRODUCING SAME, PHARMACEUTICAL PREPARATIONS THAT CONTAIN SAME, AND USE OF SAME TO PRODUCE DRUGS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-03-07 US disclosed
WO-2015028989-A1 NOVEL HETEROCYCLIC COMPOUNDS AS ANTIMALARIAL AGENTS ACTELION PHARMACEUTICALS LTD (CH) 2015-03-05 WO disclosed
EP-2318412-B1 PROTEIN KINASE INHIBITORS VERTEX PHARMA (US) 2013-08-14 EP disclosed
US-20120309747-A1 PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-12-06 US disclosed
US-8252787-B2 Protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-08-28 US disclosed
US-20120010197-A1 PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-01-12 US disclosed
WO-2009071691-A2 OXINDOLE DERIVATIVES AND THE USE THEREOF AS A MEDICATION ABBOTT GMBH & CO. KG (DE) 2009-06-11 WO disclosed
US-7297792-B2 Pyrazolopyridines and pyrazolopyridazines as antidiabetics SMITHKLINE BEECHAM CORPORATION (US) 2007-11-20 US disclosed
US-20060223800-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIDAZINES ADN ANTIDIABETICS GARLAND STEPHEN 2006-10-05 US disclosed
EP-1131295-A1 QUINOLINE-4-CARBOXAMIDE DERIVATIVES AS NK-3 AND NK-2 RECEPTOR ANTAGONISTS Smithkline Beecham S.p.A. (IT) 2001-09-12 EP disclosed
WO-2000031037-A1 QUINOLINE-4-CARBOXAMIDE DERIVATIVES AS NK-3 AND NK-2 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM S.P.A. (IT) 2000-06-02 WO 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 (5 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-20060223800-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIDAZINES ADN ANTIDIABETICS ADK, PDXK, GPR119 L3MBTL1 4857/4885L3MBTL3 4842/4885ALDH1A1 462/4885
US-10435396-B2 2-substituted indazoles, methods for producing same, pharmaceutical preparations that contain same, and use of same to produce drugs CYP11B2, CYP19A1, CYP11B1 L3MBTL1 4657/4885L3MBTL3 4580/4885ALDH1A1 433/4885
US-20120010197-A1 PROTEIN KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K6 L3MBTL1 2564/4885L3MBTL3 3189/4885ALDH1A1 3526/4885
US-20120309747-A1 PROTEIN KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K6 L3MBTL1 2564/4885L3MBTL3 3189/4885ALDH1A1 3526/4885
US-20190071432-A1 NEW 2-SUBSTITUTED INDAZOLES, METHODS FOR PRODUCING SAME, PHARMACEUTICAL PREPARATIONS THAT CONTAIN SAME, AND USE OF SAME TO PRODUCE DRUGS CYP11B2, CYP19A1, CYP11B1 L3MBTL1 4735/4885L3MBTL3 4685/4885ALDH1A1 478/4885

“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.