SCHEMBL20544017

SCHEMBL20544017

CSc1nccc(N2CCC(N(C)C(=O)O)CC2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HRH3 Q9Y5N1 4/20 0.41
HRH4 Q9H3N8 3/20 0.41
OPRD1 P41143 1/20 0.39
F10 P00742 1/20 0.38
MAP4K4 O95819 1/20 0.38
TAF1 P21675 1/20 0.37
CECR2 Q9BXF3 1/20 0.37
BRD9 Q9H8M2 1/20 0.37
KDM4E B2RXH2 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
SORD Q00796 3/20 0.36
GPR119 Q8TDV5 1/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35

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
SCHEMBL16855357 0.84 PDE10A (0.49) MAPTALDH1A1LMNAGAASMN1; SMN2
SCHEMBL27902619 0.84 ACACB (0.46) HRH3HRH4OPRD1MAP4K4SORD
SCHEMBL3650736 0.82 TRPV1 (0.46) HRH3HRH4OPRD1SORDJAK3
SCHEMBL803732 0.82 SIGMAR1 (0.45) MAPTALDH1A1LMNAGAASMN1; SMN2
SCHEMBL16855303 0.82 ALDH1A1 (0.55) MAPTALDH1A1LMNAGAASMN1; SMN2
SCHEMBL16855474 0.81 ALDH1A1 (0.40) MAPTALDH1A1LMNAGAASMN1; SMN2
SCHEMBL27920434 0.81 ACACB (0.43) HRH3HRH4OPRD1MAP4K4SORD
Hydrochloric Acid SCHEMBL18166972 0.81 ALDH1A1 (0.39) MAPTALDH1A1LMNAGAASMN1; SMN2
Hydrochloric Acid SCHEMBL18166971 0.81 ALDH1A1 (0.39) MAPTALDH1A1LMNAGAASMN1; SMN2
SCHEMBL20544120 0.81 HRH3 (0.41) HRH3HRH4OPRD1MAP4K4TAF1

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
EP-3085700-B1 NOVEL PIPERIDINE CARBOXAMIDE COMPOUND, PREPARATION METHOD, AND USAGE THEREOF INST PHARMACOLOGY & TOXICOLOGY ACADEMY MILITARY MEDICAL SCIENCES PLA CHINA (CN) 2018-10-31 EP claimed
US-11447463-B2 Piperidine carboxamide compound, preparation method, and use thereof Institute of Pharmacology and Toxicology Academy of Millitary Medical Sciences P.L.A. China (CN) 2022-09-20 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-11447463-B2 Piperidine carboxamide compound, preparation method, and use thereof HSF1, HSP90AB1, HSPD1 MAPT 301/4885ALDH1A1 936/4885LMNA 4250/4885

“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.