SCHEMBL17229285

SCHEMBL17229285

CC(C)Cc1ccc2sc(Cl)cc2c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
PNMT P11086 2/20 0.36
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
CA2 P00918 3/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
AKR1C2 P52895 1/20 0.33
AKR1C1 Q04828 1/20 0.33
FAAH O00519 1/20 0.33
SENP7 Q9BQF6 1/20 0.32
ABL1 P00519 1/20 0.32

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
SCHEMBL8179976 0.81 GABRA1 (0.41) GABRA1GABRB2HTR2AHTR2CHTR2B
SCHEMBL17232444 0.80 CYP1A2 (0.44) CA2TP53MAPTSMN1; SMN2AKR1C2
SCHEMBL24519226 0.79 GABRA1 (0.40) GABRA1GABRB2HTR2AHTR2CHTR2B
SCHEMBL17254175 0.77 CNR1 (0.39) CA2TP53MAPTSMN1; SMN2
SCHEMBL17221342 0.77 CYP2A6 (0.52) PNMTCA2
SCHEMBL30503006 0.76 MGLL (0.49)
SCHEMBL25235631 0.76 MGLL (0.49)
SCHEMBL26352371 0.74 GABRA1 (0.36) GABRA1GABRB2HTR2AHTR2CHTR2B
SCHEMBL23792203 0.73 GABRA1 (0.38) GABRA1GABRB2HTR2AHTR2CHTR2B
SCHEMBL28292686 0.72 HTR2A (0.57) GABRA1GABRB2HTR2AHTR2CHTR2B

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-9695166-B2 Pyrazolopyridine pyrazolopyrimidine and related compounds GLOBAL BLOOD THERAPEUTICS, INC. (US) 2017-07-04 US disclosed
US-9695166-B2 Pyrazolopyridine pyrazolopyrimidine and related compounds GLOBAL BLOOD THERAPEUTICS, INC. (US) 2017-07-04 US disclosed
US-20150315198-A1 PYRAZOLOPYRIDINE PYRAZOLOPYRIMIDINE AND RELATED COMPOUNDS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2015-11-05 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-20150315198-A1 PYRAZOLOPYRIDINE PYRAZOLOPYRIMIDINE AND RELATED COMPOUNDS TPMT, DPYD, XDH GABRA1 3409/4885GABRB2 3649/4885PNMT 2513/4885

“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.