SCHEMBL4075120

SCHEMBL4075120

CSC(C)(C)c1cc(N)n(-c2ccc(OCc3ccccc3)cc2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
GAA P10253 3/20 0.43
MAOB P27338 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 1/20 0.43
MAOA P21397 1/20 0.43
NPC1 O15118 2/20 0.42
PKM P14618 1/20 0.42
MDM2 Q00987 2/20 0.42
BCL2 P10415 1/20 0.41
MCL1 Q07820 1/20 0.41
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
CYP3A4 P08684 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA5A P35218 1/20 0.39

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
SCHEMBL2082879 0.88 MAPK14 (0.47) RAB9AL3MBTL1GAAMAOBSMN1; SMN2
SCHEMBL4138952 0.78 SMN1; SMN2 (0.38) RAB9AL3MBTL1SMN1; SMN2MAPTNPC1
SCHEMBL4138408 0.76 LMNA (0.41) RAB9AL3MBTL1GAASMN1; SMN2MAPT
SCHEMBL4073662 0.75 BCHE (0.50) RAB9AMAOBSMN1; SMN2NPC1CYP3A4
SCHEMBL3176111 0.73 HCK (0.40) RAB9AL3MBTL1SMN1; SMN2MAPTNPC1
SCHEMBL4076195 0.72 SMN1; SMN2 (0.44) RAB9AL3MBTL1SMN1; SMN2MAPTNPC1
SCHEMBL20396179 0.71 MEN1 (0.50) RAB9ASMN1; SMN2MAPTNPC1PKM
SCHEMBL2479480 0.71 NPC1 (0.45) RAB9AL3MBTL1SMN1; SMN2MAPTNPC1
SCHEMBL28617209 0.70 PTGS1 (0.49) RAB9AL3MBTL1GAAMAOBSMN1; SMN2
SCHEMBL4072416 0.70 ALDH1A1 (0.37) RAB9AL3MBTL1SMN1; SMN2MAPTNPC1

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-8076356-B2 Triazolopyridinylsulfanyl derivatives as P38 map kinase inhibitors PFIZER INC. (US) 2011-12-13 US disclosed
US-20090239899-A1 Triazolopyridinylsulfanyl Derivatives As P38 Map Kinase Inhibitors PFIZER INC. 2009-09-24 US disclosed
EP-1778686-B9 TRIAZOLOPYRIDINYLSULFANYL DERIVATIVES AS P38 MAP KINASE INHIBITORS PFIZER LTD (GB) 2009-07-08 EP disclosed
US-7511057-B2 Triazolopyridinylsulfanyl derivatives as p38 MAP kinase inhibitors PFIZER INC. (US) 2009-03-31 US disclosed
EP-1778686-B1 TRIAZOLOPYRIDINYLSULFANYL DERIVATIVES AS P38 MAP KINASE INHIBITORS PFIZER LTD (GB) 2008-10-29 EP disclosed
US-20060035922-A1 Triazolopyridinylsulfanyl derivatives as p38 MAP kinase inhibitors PFIZER INC. 2006-02-16 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 (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-20060035922-A1 Triazolopyridinylsulfanyl derivatives as p38 MAP kinase inhibitors MAPK1, MAPKAPK5, MAPKAPK3 RAB9A 2552/4885L3MBTL1 4004/4885GAA 1650/4885
US-20090239899-A1 Triazolopyridinylsulfanyl Derivatives As P38 Map Kinase Inhibitors MAPK1, MAPKAPK5, MAPKAPK3 RAB9A 2581/4885L3MBTL1 4227/4885GAA 1602/4885

“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.