SCHEMBL4119634

SCHEMBL4119634

CCOC(=O)c1c(N)n[nH]c1SCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 11/20 0.54
RAB9A P51151 7/20 0.54
NPC1 O15118 7/20 0.54
TSHR P16473 7/20 0.54
ALDH1A1 P00352 6/20 0.54
NFKB1 P19838 1/20 0.54
NFKB2 Q00653 1/20 0.54
RELA Q04206 1/20 0.54
HTT P42858 3/20 0.48
MAPK10 P53779 1/20 0.48
MAPK1 P28482 1/20 0.46
HSD17B10 Q99714 3/20 0.45
KDM4E B2RXH2 3/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 4/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
RECQL P46063 1/20 0.43

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
SCHEMBL10777556 0.88 METAP2 (0.47) SMN1; SMN2RAB9ANPC1TSHRALDH1A1
SCHEMBL28694118 0.82 SMN1; SMN2 (0.50) SMN1; SMN2RAB9ANPC1ALDH1A1HTT
SCHEMBL2085698 0.81 SMN1; SMN2 (0.51) SMN1; SMN2RAB9ANPC1TSHRALDH1A1
SCHEMBL10920977 0.80 SMN1; SMN2 (0.44) SMN1; SMN2RAB9ANPC1TSHRALDH1A1
SCHEMBL10921834 0.78 SMN1; SMN2 (0.43) SMN1; SMN2RAB9ANPC1TSHRALDH1A1
SCHEMBL8529906 0.78 ALOX5 (0.52) SMN1; SMN2RAB9ANPC1TSHRALDH1A1
SCHEMBL2084577 0.77 SMN1; SMN2 (0.51) SMN1; SMN2RAB9ANPC1ALDH1A1HTT
SCHEMBL10922916 0.73 SMN1; SMN2 (0.38) SMN1; SMN2RAB9ANPC1TSHRALDH1A1
SCHEMBL2928120 0.72 ALDH1A1 (0.50) SMN1; SMN2RAB9ANPC1TSHRALDH1A1
SCHEMBL6385502 0.71 SMN1; SMN2 (0.52) SMN1; SMN2RAB9ANPC1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101296699-B Pyrazolo [1,5-a ] pyrimidine compounds MITSUBISHI TANABE PHARMA CORP 2013-01-02 CN disclosed
US-8188097-B2 Pyrazolo[1,5-A]pyrimidine compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-05-29 US disclosed
US-20090069298-A1 Pyrazolo[1,5-A]Pyrimidine Compounds TANABE SEIYAKU CO., LTD. (JP) 2009-03-12 US disclosed
CN-101296699-A Pyrazolo [1, 5-a ] pyrimidine compounds MITSUBISHI TANABE PHARMA CORP (JP) 2008-10-29 CN disclosed
EP-1945220-A1 PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS AS CANNABINOID RECEPTOR ANTAGONISTS Mitsubishi Tanabe Pharma Corporation (JP) 2008-07-23 EP disclosed
WO-2007046548-A1 PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS AS CANNABINOID RECEPTOR ANTAGONISTS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-04-26 WO disclosed
US-5021591-A Herbicides THE DOW CHEMICAL COMPANY (US) 1991-06-04 US disclosed
US-4997940-A Herbicides THE DOW CHEMICAL COMPANY (US) 1991-03-05 US disclosed
US-4992091-A Herbicides THE DOW CHEMICAL COMPANY (US) 1991-02-12 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-20090069298-A1 Pyrazolo[1,5-A]Pyrimidine Compounds RECQL, QTRT1, DPYD SMN1; SMN2 3307/4885RAB9A 364/4885NPC1 3153/4885

“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.