SCHEMBL9963240

SCHEMBL9963240

Cc1ccc(CC2(O)CCN(C(C)C)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 8/20 0.54
GRIN2D O15399 7/20 0.54
GRIN3B O60391 7/20 0.54
GRIN1 Q05586 7/20 0.54
GRIN2A Q12879 7/20 0.54
GRIN2C Q14957 7/20 0.54
GRIN3A Q8TCU5 7/20 0.54
ADRA1A P35348 6/20 0.54
ADRA1D P25100 4/20 0.54
ADRA1B P35368 4/20 0.54
OPRM1 P35372 3/20 0.51
OPRD1 P41143 3/20 0.51
OPRK1 P41145 3/20 0.51
OPRL1 P41146 3/20 0.51
MAPT P10636 1/20 0.50
CYP2D6 P10635 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
GPR4 P46093 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL20147416 0.86 OPRM1 (0.50) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL9963238 0.85 OPRL1 (0.69) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL20147414 0.82 OPRM1 (0.50) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL13231735 0.81 GRIN2D (0.57) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL18911954 0.80 GRIN2B (0.51) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL21651971 0.79 GRIN2B (0.59) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL25499870 0.78 OPRM1 (0.40) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7288263 0.77 GRIN2B (0.65) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5993589 0.76 CYP46A1 (0.50) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL20008961 0.76 OPRL1 (0.61) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11648243-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2023-05-16 US disclosed
US-11648243-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2023-05-16 US disclosed
US-20180148445-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-31 US disclosed
US-20180148445-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-31 US disclosed
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 US disclosed
US-20180133207-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 US disclosed
US-8354403-B2 Pyrrolidine derived beta 3 adrenergic receptor agonists MERCK SHARP & DOHME CORP. (US) 2013-01-15 US disclosed
US-20120157432-A1 NOVEL PYRROLIDINE DERIVED BETA 3 ADRENERGIC RECEPTOR AGONISTS MERCK SHARP & DOHME, CORP. (US) 2012-06-21 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 (5 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-20180148445-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 GRIN2B 1206/4885GRIN2D 1440/4885GRIN3B 721/4885
US-11648243-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 GRIN2B 1206/4885GRIN2D 1440/4885GRIN3B 721/4885
US-20120157432-A1 NOVEL PYRROLIDINE DERIVED BETA 3 ADRENERGIC RECEPTOR AGONISTS ADRB3, ADRB1, ADRB2 GRIN2B 1257/4885GRIN2D 1483/4885GRIN3B 600/4885
US-20180133207-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 GRIN2B 1206/4885GRIN2D 1440/4885GRIN3B 721/4885
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 GRIN2B 1206/4885GRIN2D 1440/4885GRIN3B 721/4885

“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.