SCHEMBL20152056

SCHEMBL20152056

CC(C)N1CCC(NC(=O)OC2CCC2)CC1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.57
HRH3 Q9Y5N1 12/20 0.48
ALDH1A1 P00352 1/20 0.46
CYP2D6 P10635 1/20 0.46
MAPT P10636 1/20 0.41
ACKR3 P25106 1/20 0.40

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
SCHEMBL13663382 0.82 ALDH1A1 (0.51) HRH3ALDH1A1CYP2D6MAPTACKR3
SCHEMBL24733368 0.79 HRH3 (0.47) EPHX1HRH3ALDH1A1CYP2D6MAPT
SCHEMBL12162963 0.79 EPHX1 (0.80) EPHX1ALDH1A1MAPT
SCHEMBL12163057 0.79 EPHX1 (0.88) EPHX1ALDH1A1MAPT
SCHEMBL20147696 0.79 HRH3 (0.42) EPHX1HRH3
SCHEMBL15131702 0.79 HSD11B1 (0.49) HRH3ALDH1A1CYP2D6MAPTACKR3
SCHEMBL18855728 0.77 EPHX1 (0.92) EPHX1ALDH1A1MAPT
SCHEMBL1456569 0.76 CTSK (0.55) EPHX1HRH3ALDH1A1CYP2D6MAPT
SCHEMBL222409 0.76 ALDH1A1 (0.47) HRH3ALDH1A1CYP2D6MAPTACKR3
SCHEMBL20365873 0.76 EPHX1 (0.96) EPHX1ALDH1A1MAPT

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-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
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 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 (2 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-10172845-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 EPHX1 1481/4885HRH3 1000/4885ALDH1A1 2547/4885
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 EPHX1 1481/4885HRH3 1000/4885ALDH1A1 2547/4885

“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.