SCHEMBL22984307

SCHEMBL22984307

Cc1ccc2nc(C)c(C(=O)NCc3ccc4c(c3)CC(OCC3CCC3)O4)n2c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.45
LMNA P02545 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 4/20 0.41
GAA P10253 3/20 0.41
PKM P14618 1/20 0.39
MAPT P10636 1/20 0.39
METTL3 Q86U44 8/20 0.35
GPR55 Q9Y2T6 1/20 0.34
RAB9A P51151 1/20 0.34
METTL14 Q9HCE5 2/20 0.34
GLA P06280 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
SCHEMBL22984265 0.85 HTT (0.48) HTTLMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL22984293 0.83 HTT (0.52) HTTLMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL22984310 0.79 HTT (0.46) HTTLMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL22984267 0.78 HTT (0.47) HTTLMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL22984263 0.77 ALDH1A1 (0.48) HTTLMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL22984313 0.77 HTT (0.54) HTTLMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL22984245 0.76 HTT (0.55) HTTLMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL22984249 0.76 CYP2C9 (0.45) HTTLMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL18642291 0.76 SMN1; SMN2 (0.51) HTTLMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL22984369 0.75 SMN1; SMN2 (0.66) HTTLMNASMN1; SMN2L3MBTL1ALDH1A1

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-10919888-B2 Benzyl amine-containing heterocyclic compounds and compositions useful against mycobacterial infection UNIVERSITY OF NOTRE DAME DU LAC (US) 2021-02-16 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-10919888-B2 Benzyl amine-containing heterocyclic compounds and compositions useful against mycobacterial infection BET1, BRD4, BRD3 HTT 4525/4885LMNA 1620/4885SMN1; SMN2 3362/4885

“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.