SCHEMBL10834334

SCHEMBL10834334

CN(C)C(=O)c1cnn2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 8/20 0.52
▸ RAB9A P51151 8/20 0.52
▸ ALDH1A1 P00352 8/20 0.52
▸ SMN1; SMN2 Q16637 5/20 0.52
▸ MAPT P10636 2/20 0.52
▸ GAA P10253 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ EPHB3 P54753 5/20 0.51
▸ RIPK2 O43353 1/20 0.51
▸ LCK P06239 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ KLF5 Q13887 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ KDM4E B2RXH2 5/20 0.50
▸ HTT P42858 3/20 0.50
▸ TP53 P04637 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ LMNA P02545 1/20 0.50
▸ MAPK1 P28482 1/20 0.48

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
Trifluoroacetic Acid SCHEMBL17967746 0.90 EPHB3 (0.50) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL17867589 0.85 NPC1 (0.51) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL30321099 0.83 NPC1 (0.54) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL1286674 0.81 NPC1 (0.68) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL3457843 0.80 ALDH1A1 (0.59) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL416200 0.80 EPHB3 (0.56) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL11300658 0.78 EPHB3 (0.55) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL30152645 0.78 EPHB3 (0.55) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL19119427 0.78 EPHB3 (0.55) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL1044120 0.78 EPHB3 (0.58) NPC1RAB9AALDH1A1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4604400-A ANTIARTHRITIC AGENTS MAY & BAKER LIMITED (GB) 1986-08-05 — — US claimed
EP-3286185-A1 SUBSTITUTED PYRAZOLO[1,5-A]-PYRIDINE-3-CARBOXAMIDES AND USE THEREOF Bayer Pharma Aktiengesellschaft (DE) 2018-02-28 — — EP disclosed
EP-2791139-B1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS TROPOMYOSIN RECEPTOR KINASE A (TRKA) INHIBITORS Dr Reddys Laboratories Ltd (IN) 2017-11-08 — — EP disclosed
US-9422285-B2 Substituted pyrazolo[1,5-A]-pyridine-3-carboxamides and use thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-08-23 — — US disclosed
WO-2016124565-A1 SUBSTITUTED PYRAZOLO[1,5-A]-PYRIDINE-3-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-08-11 — — WO disclosed
US-20160185775-A1 SUBSTITUTED PYRAZOLO[1,5-A]-PYRIDINE-3-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-06-30 — — US disclosed
EP-2791139-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS TROPOMYOSIN RECEPTOR KINASE A (TRKA) INHIBITORS Dr. Reddy's Laboratories Ltd. (IN) 2014-10-22 — — EP disclosed
WO-2013088257-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS TROPOMYOSIN RECEPTOR KINASE A (TRKA) INHIBITORS DR. REDDY'S LABORATORIES LTD. (IN) 2013-06-20 — — WO disclosed
US-4604400-A ANTIARTHRITIC AGENTS MAY & BAKER LIMITED (GB) 1986-08-05 — — US disclosed
US-4604400-A ANTIARTHRITIC AGENTS MAY & BAKER LIMITED (GB) 1986-08-05 — — US disclosed
US-4604400-A ANTIARTHRITIC AGENTS MAY & BAKER LIMITED (GB) 1986-08-05 — — 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 (1 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-20160185775-A1 SUBSTITUTED PYRAZOLO[1,5-A]-PYRIDINE-3-CARBOXAMIDES AND USE THEREOF PC, AADAC, PDXK NPC1 1781/4885RAB9A 3735/4885ALDH1A1 615/4885

“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.

Send feedback