SCHEMBL20069043

SCHEMBL20069043

CC(C)CC(=O)NC1(C)CCN(C)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.42
TP53 P04637 1/20 0.42
DPP4 P27487 2/20 0.37
CCR1 P32246 1/20 0.36
CCNT1 O60563 1/20 0.36
ULK1 O75385 1/20 0.36
PRKD3 O94806 1/20 0.36
PAK4 O96013 1/20 0.36
CDK1 P06493 1/20 0.36
CDK4 P11802 1/20 0.36
CCNB1 P14635 1/20 0.36
PHKG2 P15735 1/20 0.36
ERCC2 P18074 1/20 0.36
CCNA2 P20248 1/20 0.36
CCND1 P24385 1/20 0.36
CCNE1 P24864 1/20 0.36
CDK2 P24941 1/20 0.36
MAPK3 P27361 1/20 0.36
CLK1 P49759 1/20 0.36
CLK2 P49760 1/20 0.36

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
SCHEMBL15116430 0.85 SMN1; SMN2 (0.38) SMN1; SMN2TP53DPP4ALDH1A1LMNA
SCHEMBL20147467 0.85 TP53 (0.38) SMN1; SMN2TP53DPP4CCR1RET
SCHEMBL15125084 0.82 SMN1; SMN2 (0.36) SMN1; SMN2TP53DPP4ALDH1A1GAA
SCHEMBL15116394 0.82 SMN1; SMN2 (0.36) SMN1; SMN2TP53DPP4ALDH1A1GAA
SCHEMBL16509334 0.80 KDM4E (0.34)
SCHEMBL15116433 0.80 SMN1; SMN2 (0.35) SMN1; SMN2TP53DPP4ALDH1A1GAA
SCHEMBL20070061 0.80 SMN1; SMN2 (0.41) SMN1; SMN2TP53DPP4CCR1CCNT1
SCHEMBL26780294 0.77 ALDH1A1 (0.43) SMN1; SMN2TP53DPP4RETALDH1A1
SCHEMBL20068864 0.77 CYP2C19 (0.44) TP53RETGAACYP2C19
SCHEMBL18347937 0.77 CYP1A2 (0.34) CCR1RET

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 5 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-10172845-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2019-01-08 US disclosed
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 US disclosed
WO-2018071454-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ANDREWS STEVEN W (US) 2018-04-19 WO 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 (4 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 SMN1; SMN2 646/4885TP53 759/4885DPP4 1963/4885
US-20200030311-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 SMN1; SMN2 646/4885TP53 759/4885DPP4 1963/4885
US-10172845-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 SMN1; SMN2 646/4885TP53 759/4885DPP4 1963/4885
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 SMN1; SMN2 646/4885TP53 759/4885DPP4 1963/4885

“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.