SCHEMBL22857026

SCHEMBL22857026

CCN1CCC(C)(C(=O)NCC2CCCO2)CC1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.57
ALDH1A1 P00352 2/20 0.57
TSHR P16473 2/20 0.50
PKM P14618 2/20 0.48
SMN1; SMN2 Q16637 3/20 0.46
USP2 O75604 1/20 0.46
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
HPGD P15428 1/20 0.45
ALOX12 P18054 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL20069676 0.87 TSHR (0.52) KDM4EALDH1A1TSHRPKMSMN1; SMN2
SCHEMBL20147939 0.84 TSHR (0.49) KDM4EALDH1A1TSHRPKMSMN1; SMN2
SCHEMBL22857092 0.80 RET (0.40) KDM4EALDH1A1
Hydrochloric Acid SCHEMBL21640977 0.72 TSHR (0.47) ALDH1A1TSHRSMN1; SMN2USP2LMNA
SCHEMBL3154658 0.70 USP2 (0.70) KDM4EALDH1A1PKMSMN1; SMN2USP2
SCHEMBL26789169 0.70 USP2 (0.70) KDM4EALDH1A1PKMSMN1; SMN2USP2
SCHEMBL26789172 0.70 USP2 (0.70) KDM4EALDH1A1PKMSMN1; SMN2USP2
SCHEMBL12409354 0.69 SMN1; SMN2 (0.64) PKMSMN1; SMN2USP2LMNATP53
SCHEMBL1101625 0.69 SMN1; SMN2 (0.64) PKMSMN1; SMN2USP2LMNATP53
SCHEMBL12409226 0.69 SMN1; SMN2 (0.64) PKMSMN1; SMN2USP2LMNATP53

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 KDM4E 547/4885ALDH1A1 2547/4885TSHR 1441/4885

“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.