SCHEMBL20158527

SCHEMBL20158527

SN1CCC(Cc2ccccn2)CC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
EPHX2 P34913 1/20 0.46
MAP4K4 O95819 1/20 0.44
HRH3 Q9Y5N1 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
GABRA1 P14867 1/20 0.39
GABRA5 P31644 1/20 0.39
TRPV6 Q9H1D0 1/20 0.39
HRH1 P35367 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
SCHEMBL1515445 0.84 SMN1; SMN2 (0.48) KDM4ESMN1; SMN2EPHX2MAP4K4HRH3
SCHEMBL8302404 0.83 KDM4E (0.50) KDM4ESMN1; SMN2EPHX2MAP4K4HRH3
SCHEMBL17754055 0.81 KDM4E (0.51) KDM4ESMN1; SMN2EPHX2MAP4K4HRH3
SCHEMBL1515203 0.80 HPGD (0.49) KDM4ESMN1; SMN2EPHX2HRH3L3MBTL1
SCHEMBL17886847 0.80 KDM4E (0.47) KDM4ESMN1; SMN2EPHX2MAP4K4HRH3
SCHEMBL14507938 0.80 HRH3 (0.49) KDM4ESMN1; SMN2EPHX2MAP4K4HRH3
SCHEMBL8911524 0.79 HPGD (0.55) KDM4ESMN1; SMN2HRH3L3MBTL1CYP1A2
SCHEMBL12090211 0.79 MAP4K4 (0.49) KDM4ESMN1; SMN2EPHX2MAP4K4HRH3
SCHEMBL25435276 0.78 KDM4E (0.52) KDM4ESMN1; SMN2HRH3CYP2C19
SCHEMBL21078309 0.78 KDM4E (0.49) KDM4ESMN1; SMN2EPHX2MAP4K4HRH3

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 2 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

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 KDM4E 547/4885SMN1; SMN2 646/4885EPHX2 2451/4885
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 KDM4E 547/4885SMN1; SMN2 646/4885EPHX2 2451/4885

“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.