SCHEMBL7159

SCHEMBL7159

CN1CCN(C(=O)c2cccc(Br)n2)CC1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 2/20 0.50
HPGD P15428 2/20 0.50
GNE Q9Y223 1/20 0.50
TSHR P16473 1/20 0.50
HRH4 Q9H3N8 5/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
KDM4A O75164 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
USP2 O75604 1/20 0.47
MAPK1 P28482 1/20 0.47
POLB P06746 2/20 0.47
ERN1 O75460 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 1/20 0.46
KDM4C Q9H3R0 1/20 0.46

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
SCHEMBL1579475 0.86 GNE (0.55) IRAK4HPGDGNETSHRSMN1; SMN2
SCHEMBL5237 0.85 GNE (0.68) HPGDGNESMN1; SMN2NPC1RAB9A
SCHEMBL2532948 0.84 GNE (0.66) HPGDGNETSHRSMN1; SMN2NPC1
SCHEMBL2966899 0.84 HRH3 (0.51) GNESMN1; SMN2HRH3USP2MAPK1
SCHEMBL2590496 0.82 HSD11B1 (0.60) HPGDGNETSHRSMN1; SMN2NPC1
SCHEMBL3759078 0.82 GNE (0.48) IRAK4HPGDGNETSHRSMN1; SMN2
SCHEMBL31395167 0.81 HRH4 (0.53) HPGDGNETSHRHRH4SMN1; SMN2
SCHEMBL1554586 0.81 RAB9A (0.50) HPGDGNESMN1; SMN2NPC1RAB9A
SCHEMBL2594231 0.81 GNE (0.50) IRAK4HPGDGNETSHRSMN1; SMN2
SCHEMBL30911663 0.81 RAB9A (0.50) HPGDGNESMN1; SMN2NPC1RAB9A

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11939301-B2 5HT1F receptor agonists and mitochondrial biogenesis MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2024-03-26 US disclosed
US-20210238147-A1 5HT1F RECEPTOR AGONISTS AND MITOCHONDRIAL BIOGENESIS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT 2021-08-05 US disclosed
US-20210238147-A1 5HT1F RECEPTOR AGONISTS AND MITOCHONDRIAL BIOGENESIS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT 2021-08-05 US disclosed
US-11014892-B2 5HT1F receptor agonists and mitochondrial biogenesis MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2021-05-25 US disclosed
US-11014892-B2 5HT1F receptor agonists and mitochondrial biogenesis MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2021-05-25 US disclosed
US-20200055827-A1 5HT1F RECEPTOR AGONISTS AND MITOCHONDRIAL BIOGENESIS MEDICAL UNIVERSITY OF SOUTH CAROLINA 2020-02-20 US disclosed
US-20200055827-A1 5HT1F RECEPTOR AGONISTS AND MITOCHONDRIAL BIOGENESIS MEDICAL UNIVERSITY OF SOUTH CAROLINA 2020-02-20 US disclosed
US-9624182-B2 Compounds as lysophosphatidic acid receptor antagonists AMIRA PHARMACEUTICALS, INC. (US) 2017-04-18 US disclosed
US-9624182-B2 Compounds as lysophosphatidic acid receptor antagonists AMIRA PHARMACEUTICALS, INC. (US) 2017-04-18 US disclosed
US-9624182-B2 Compounds as lysophosphatidic acid receptor antagonists AMIRA PHARMACEUTICALS, INC. (US) 2017-04-18 US disclosed
US-9090573-B2 Compounds as lysophosphatidic acid receptor antagonists AMIRA PHARMACEUTICALS, INC. (US) 2015-07-28 US disclosed
US-9090573-B2 Compounds as lysophosphatidic acid receptor antagonists AMIRA PHARMACEUTICALS, INC. (US) 2015-07-28 US disclosed
US-9090573-B2 Compounds as lysophosphatidic acid receptor antagonists AMIRA PHARMACEUTICALS, INC. (US) 2015-07-28 US disclosed
US-20120289522-A1 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS INC. 2012-11-15 US disclosed
US-20120289522-A1 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS INC. 2012-11-15 US disclosed
US-20120289522-A1 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS INC. 2012-11-15 US disclosed
CN-102639515-A Compounds as lysophosphatidic acid receptor antagonists AMIRA PHARMACEUTICALS INC 2012-08-15 CN disclosed
EP-2483252-A2 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS Amira Pharmaceuticals, Inc. (US) 2012-08-08 EP disclosed
WO-2011041694-A2 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS, INC. (US) 2011-04-07 WO disclosed
WO-2011041694-A2 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS, INC. (US) 2011-04-07 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-11939301-B2 5HT1F receptor agonists and mitochondrial biogenesis HTR1F, HTR1A, TFAM IRAK4 3358/4885HPGD 1071/4885GNE 4792/4885
US-11014892-B2 5HT1F receptor agonists and mitochondrial biogenesis HTR1F, HTR1A, TFAM IRAK4 3358/4885HPGD 1071/4885GNE 4792/4885
US-20120289522-A1 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS LPAR1, LPAR2, LPAR4 IRAK4 1085/4885HPGD 1947/4885GNE 1866/4885
US-20200055827-A1 5HT1F RECEPTOR AGONISTS AND MITOCHONDRIAL BIOGENESIS HTR1F, HTR1A, TFAM IRAK4 3358/4885HPGD 1071/4885GNE 4792/4885
US-20210238147-A1 5HT1F RECEPTOR AGONISTS AND MITOCHONDRIAL BIOGENESIS HTR1F, HTR1A, TFAM IRAK4 3358/4885HPGD 1071/4885GNE 4792/4885

“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.