SCHEMBL21859073

SCHEMBL21859073

CCn1cc(C(=O)N2CC3COCC(C3)C2)c(=O)c2nc(Cl)ccc21

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.41
SPR P35270 2/20 0.39
GLA P06280 1/20 0.38
USP2 O75604 1/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TP53 P04637 1/20 0.33

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
SCHEMBL24037263 0.84 TSHR (0.40) LMNATSHRGLAUSP2MEN1
SCHEMBL24037435 0.83 USP2 (0.54) LMNATSHRGLAUSP2MEN1
SCHEMBL24037486 0.81 LMNA (0.38) LMNATSHRSPRGLAUSP2
SCHEMBL24037531 0.79 HTR2C (0.42) LMNATSHRMEN1KMT2AKDM4E
SCHEMBL24037529 0.79 HTR2C (0.42) LMNATSHRMEN1KMT2AKDM4E
SCHEMBL30776995 0.77 LMNA (0.41) LMNATSHRSPRGLAUSP2
SCHEMBL30777001 0.77 LMNA (0.41) LMNATSHRSPRGLAUSP2
SCHEMBL24037650 0.77 LMNA (0.41) LMNATSHRSPRGLAUSP2
SCHEMBL24037264 0.76 KDM4E (0.50) LMNATSHRMEN1KMT2AKDM4E
SCHEMBL24037407 0.74 LMNA (0.33) LMNATSHRUSP2MEN1KMT2A

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-20210355124-A1 Cyclic compounds as receptor modulating therapeutics and methods and uses thereof BIONOMICS LIMITED (AU) 2021-11-18 US disclosed
WO-2020077414-A1 CYCLIC COMPOUNDS AS RECEPTOR MODULATING THERAPEUTICS AND METHODS AND USES THEREOF BIONOMICS LIMITED (AU) 2020-04-23 WO 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-20210355124-A1 Cyclic compounds as receptor modulating therapeutics and methods and uses thereof CHRNA7, CHRNA1, CHRNA5 LMNA 2733/4885TSHR 258/4885SPR 1663/4885

“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.