SCHEMBL3193397

SCHEMBL3193397

CSc1nc2cc[c]cc2s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
PKM P14618 2/20 0.45
ALDH1A1 P00352 5/20 0.39
NPC1 O15118 4/20 0.39
MAPT P10636 4/20 0.39
HPGD P15428 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 2/20 0.39
ADRA2A P08913 1/20 0.39
FBP1 P09467 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
DRD2 P14416 1/20 0.39
ALOX15 P16050 1/20 0.39
ADRA2B P18089 1/20 0.39
ADRA2C P18825 1/20 0.39
DRD1 P21728 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
SCHEMBL3191166 0.81 MEN1 (0.41) KEAP1SMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL693730 0.77 GAA (0.50) SMN1; SMN2PKMALDH1A1NPC1MAPT
SCHEMBL316415 0.73 ALDH1A1 (0.70) KEAP1SMN1; SMN2NPSR1PKMALDH1A1
SCHEMBL145436 0.73 KDM4E (0.30) SMN1; SMN2NPSR1ALDH1A1NPC1MAPT
SCHEMBL29368613 0.73 ALDH1A1 (0.70) KEAP1SMN1; SMN2NPSR1PKMALDH1A1
SCHEMBL25429178 0.72
SCHEMBL406704 0.72 RAB9A (0.47) SMN1; SMN2PKMALDH1A1NPC1MAPT
SCHEMBL1360954 0.72 KMT2A (0.40) SMN1; SMN2ALDH1A1NPC1MAPTMEN1
SCHEMBL9874615 0.71 LOXL2 (0.39) SMN1; SMN2NPC1MAPTHPGDRAB9A
SCHEMBL5796120 0.71 NPC1 (0.53) SMN1; SMN2NPSR1PKMNPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7667036-B2 MAPKAP-K2 (mitogen-activated protein kinase-activated protein kinase 2) inhibitors; inflammatory, autoimmune disease, destructive bone disorder, cancer and/or tumor growth; angiogenesis, diabetes and neurological disorders TEIJIN PHARMA LIMITED (JP) 2010-02-23 US disclosed
EP-1780212-A1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVE Teijin Pharma Limited (JP) 2007-05-02 EP disclosed
US-20060135514-A1 Pyrazolo[1,5-a]pyrimidine derivatives TEIJIN PHARMA LIMITED 2006-06-22 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-20060135514-A1 Pyrazolo[1,5-a]pyrimidine derivatives MAPKAPK2, MAPKAPK5, MAP4K2 KEAP1 1888/4885SMN1; SMN2 3512/4885NPSR1 4469/4885

“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.