SCHEMBL20152350

SCHEMBL20152350

COc1ccc(C(=O)N2C3COCC2CN(C(C)(C)C)C3)cn1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RET P07949 5/20 0.47
NNMT P40261 1/20 0.44
GPR183 P32249 6/20 0.40
MGLL Q99685 1/20 0.39
KCNH2 Q12809 1/20 0.39
LRRK2 Q5S007 1/20 0.39
TACR3 P29371 1/20 0.39
GPR119 Q8TDV5 1/20 0.38
MKNK1 Q9BUB5 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
PDE2A O00408 1/20 0.38
FFAR2 O15552 1/20 0.37
GRIN2B Q13224 1/20 0.37

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
SCHEMBL20154563 0.87 NNMT (0.47) RETNNMTGPR183MGLLKCNH2
SCHEMBL20148719 0.84 HRH3 (0.44) RETNNMTGPR183MGLLKCNH2
SCHEMBL23555184 0.80 RET (0.41) RETNNMTGPR183MGLLKCNH2
SCHEMBL20160459 0.79 RET (0.48) RETGPR183TACR3
SCHEMBL23555183 0.78 GPR183 (0.42) RETNNMTGPR183MGLLKCNH2
SCHEMBL18713231 0.77 NNMT (0.49) RETNNMTGPR183MGLLKCNH2
SCHEMBL20071400 0.76 NNMT (0.43) RETNNMTGPR183MGLLKCNH2
SCHEMBL18390346 0.74 NNMT (0.49) RETNNMTGPR183MGLLKCNH2
SCHEMBL20962681 0.74 NNMT (0.46) RETNNMTGPR183MGLLKCNH2
SCHEMBL18390347 0.74 NNMT (0.46) RETNNMTGPR183MGLLKCNH2

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-20180134702-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 US disclosed
US-20180134702-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 (1 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-20180134702-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF RET 1/4885NNMT 2639/4885GPR183 1682/4885

“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.