SCHEMBL20205874

SCHEMBL20205874

CN1CCC(S(=O)(=O)CC2CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.40
ACHE P22303 2/20 0.34
CTSS P25774 1/20 0.34
HTR2A P28223 3/20 0.33
HTR2C P28335 3/20 0.33
CNR2 P34972 2/20 0.32
CYP2D6 P10635 1/20 0.31
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
TYK2 P29597 1/20 0.31
JAK3 P52333 1/20 0.31

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
SCHEMBL15606535 0.90 NCF1 (0.34) NCF1ACHECTSSJAK2JAK1
SCHEMBL14820410 0.81 JAK2 (0.33) CTSSCNR2JAK2JAK1TYK2
SCHEMBL13162843 0.80 NCF1 (0.39) NCF1HTR2AHTR2C
SCHEMBL20070397 0.79 CTSS (0.32) CTSSJAK2JAK1TYK2JAK3
SCHEMBL14836376 0.79 CTSS (0.32) CTSS
SCHEMBL20147689 0.79 JAK2 (0.38) CTSSCYP2D6JAK2JAK1
SCHEMBL14311259 0.75 HTR2A (0.36) NCF1HTR2AHTR2C
SCHEMBL20070399 0.74 HRH3 (0.34) CTSSJAK2JAK1
SCHEMBL12439743 0.74 NCF1 (0.48) NCF1ACHECNR2
SCHEMBL20068991 0.73 NCF1 (0.34) NCF1HTR2AHTR2C

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-20200383966-A9 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2020-12-10 US disclosed
US-20200030311-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA, INC. 2020-01-30 US disclosed
US-20180148445-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-31 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 (3 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-20200383966-A9 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 NCF1 1097/4885ACHE 4091/4885CTSS 4551/4885
US-20180148445-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 NCF1 1097/4885ACHE 4091/4885CTSS 4551/4885
US-20200030311-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 NCF1 1097/4885ACHE 4091/4885CTSS 4551/4885

“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.