SCHEMBL22857097

SCHEMBL22857097

CC(C)N1CCC(C)(N2CCCC2=O)CC1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.37
BRD4 O60885 1/20 0.35
BRD2 P25440 1/20 0.35
CYP2D6 P10635 1/20 0.35
ALDH1A1 P00352 1/20 0.33
CHRNA7 P36544 1/20 0.32
LMNA P02545 1/20 0.30

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
SCHEMBL22857098 0.84 PIK3CD (0.37) PIK3CDBRD4BRD2ALDH1A1LMNA
SCHEMBL25157210 0.81 BRD4 (0.43) PIK3CDBRD4BRD2CYP2D6ALDH1A1
SCHEMBL2999035 0.80 BRD4 (0.41) PIK3CDBRD4BRD2ALDH1A1LMNA
SCHEMBL25157105 0.75 ALDH1A1 (0.41) PIK3CDBRD4BRD2ALDH1A1
SCHEMBL24749998 0.74 AR (0.39) BRD4BRD2ALDH1A1
SCHEMBL2994796 0.71 ALDH1A1 (0.37) BRD4BRD2ALDH1A1
SCHEMBL25157379 0.71 BRD4 (0.40) PIK3CDBRD4BRD2ALDH1A1LMNA
SCHEMBL6160033 0.70 ALDH1A1 (0.34) BRD4BRD2ALDH1A1
SCHEMBL6160038 0.70 ALDH1A1 (0.34) BRD4BRD2ALDH1A1
SCHEMBL25525530 0.70 PIK3CD (0.35) PIK3CDBRD4BRD2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10881652-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2021-01-05 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-10881652-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 PIK3CD 1807/4885BRD4 899/4885BRD2 1337/4885

“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.