SCHEMBL18705187

SCHEMBL18705187

CC(C)N1CCC2(CC1)CN(C(=O)c1ccccc1)C2

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.58
CYP3A4 P08684 8/20 0.53
USP2 O75604 7/20 0.53
CYP2D6 P10635 7/20 0.53
CYP1A2 P05177 7/20 0.53
TSHR P16473 7/20 0.53
CYP2C9 P11712 6/20 0.53
CYP2C19 P33261 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.51
HIF1A Q16665 2/20 0.51
MAPK1 P28482 1/20 0.51
MGLL Q99685 2/20 0.50
ALDH1A1 P00352 4/20 0.49
TP53 P04637 1/20 0.49
HPGD P15428 1/20 0.49

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
SCHEMBL18389857 0.83 CYP3A4 (0.58) CYP3A4USP2CYP2D6CYP1A2TSHR
SCHEMBL20315447 0.82 CYP2D6 (0.47) HRH3CYP3A4USP2CYP2D6CYP1A2
SCHEMBL12777929 0.81 MAOB (0.68) HRH3USP2ALDH1A1HPGD
SCHEMBL20353690 0.79 ALDH1A1 (0.49) HRH3CYP3A4USP2CYP2D6CYP1A2
SCHEMBL20970963 0.79 CHRM2 (0.58) CYP3A4CYP2D6CYP1A2TSHRCYP2C9
SCHEMBL20070899 0.79 CYP2D6 (0.47) HRH3CYP3A4USP2CYP2D6CYP2C9
SCHEMBL30634133 0.79 HPGD (0.56) HRH3CYP3A4USP2CYP2D6CYP1A2
SCHEMBL18705198 0.79 KDM4E (0.52) HRH3CYP3A4USP2CYP2D6CYP1A2
SCHEMBL19159719 0.78 MGLL (0.66) HRH3CYP3A4USP2CYP2D6CYP1A2
SCHEMBL1447408 0.76 HRH3 (0.71) HRH3USP2SMN1; SMN2ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190127373-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2019-05-02 US disclosed
US-10174027-B2 Substituted pyrazolo[1,5-a]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2019-01-08 US disclosed
US-10174028-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2019-01-08 US disclosed
US-10023570-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2018-07-17 US disclosed
US-10023570-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2018-07-17 US disclosed
US-20180186790-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-07-05 US disclosed
US-20180179203-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-06-28 US disclosed
US-20170096425-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA, INC. 2017-04-06 US disclosed
US-20170096425-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA, INC. 2017-04-06 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 (7 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-20190127373-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF HRH3 1340/4885CYP3A4 2929/4885USP2 3928/4885
US-10174027-B2 Substituted pyrazolo[1,5-a]pyridine compounds as RET kinase inhibitors RET, ROR1, BRAF HRH3 1340/4885CYP3A4 2929/4885USP2 3928/4885
US-20170096425-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF HRH3 1340/4885CYP3A4 2929/4885USP2 3928/4885
US-10174028-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, ROR1, BRAF HRH3 1340/4885CYP3A4 2929/4885USP2 3928/4885
US-20180186790-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF HRH3 1340/4885CYP3A4 2929/4885USP2 3928/4885
US-20180179203-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF HRH3 1340/4885CYP3A4 2929/4885USP2 3928/4885
US-10023570-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, ROR1, BRAF HRH3 1340/4885CYP3A4 2929/4885USP2 3928/4885

“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.