SCHEMBL20158879

SCHEMBL20158879

CCN1CCC(CN2CCC(F)(F)C2)(NC(=O)c2cc(F)ccc2C)CC1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RET P07949 12/20 0.54
P2RX7 Q99572 1/20 0.38
RIPK1 Q13546 1/20 0.37
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
ABL1 P00519 1/20 0.35
TSHR P16473 1/20 0.35
HDAC4 P56524 1/20 0.35
HSD11B1 P28845 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL20068930 0.92 RET (0.52) RETP2RX7RIPK1PDCD1CD274
SCHEMBL20147597 0.90 RET (0.51) RETP2RX7RIPK1PDCD1CD274
SCHEMBL20069673 0.85 RET (0.52) RETTSHRHSD11B1
SCHEMBL20147587 0.85 RET (0.50) RETP2RX7TSHRHSD11B1
SCHEMBL25503846 0.83 RET (0.49) RETP2RX7TSHRHSD11B1
SCHEMBL20158496 0.81 RET (0.53) RETP2RX7TSHRHSD11B1L3MBTL1
SCHEMBL21651991 0.80 CCR3 (0.49) RET
SCHEMBL20069671 0.78 RET (0.52) RETP2RX7HDAC4
SCHEMBL20147590 0.78 RET (0.50) RETP2RX7HDAC4
SCHEMBL20069663 0.76 RET (0.52) RET

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 RET 1/4885P2RX7 1456/4885RIPK1 269/4885
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 RET 1/4885P2RX7 1456/4885RIPK1 269/4885

“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.