SCHEMBL10953074

SCHEMBL10953074

CCC(Br)C(=O)N1CCN(C/C=C/c2ccccc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 7/20 0.68
▸ TSHR P16473 1/20 0.68
▸ CHRM3 P20309 1/20 0.60
▸ MEN1 O00255 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ USP2 O75604 1/20 0.58
▸ HTT P42858 2/20 0.58
▸ ALDH1A1 P00352 6/20 0.57
▸ MAPT P10636 3/20 0.57
▸ GAA P10253 2/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ KDM4E B2RXH2 1/20 0.53

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
SCHEMBL10953062 1.00 LMNA (0.68) LMNATSHRCHRM3MEN1KMT2A
SCHEMBL28129212 0.81 CHRM3 (0.70) LMNATSHRCHRM3MEN1KMT2A
SCHEMBL28129211 0.81 CHRM3 (0.70) LMNATSHRCHRM3MEN1KMT2A
SCHEMBL7365405 0.80 LMNA (0.68) LMNATSHRMEN1KMT2AUSP2
SCHEMBL7365408 0.80 LMNA (0.68) LMNATSHRMEN1KMT2AUSP2
SCHEMBL5487379 0.80 LMNA (0.72) LMNACHRM3MEN1KMT2AUSP2
SCHEMBL5487375 0.80 LMNA (0.72) LMNACHRM3MEN1KMT2AUSP2
SCHEMBL11002647 0.78 LMNA (0.70) LMNATSHRMEN1KMT2AUSP2
SCHEMBL11002645 0.78 LMNA (0.70) LMNATSHRMEN1KMT2AUSP2
SCHEMBL10956251 0.78 LMNA (0.59) LMNATSHRCHRM3MEN1KMT2A

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-0089900-B1 NEW N-((2-OXO-1-PYRROLIDINYL)ACETYL)PIPERAZINES, THE METHODS OF PRODUCING SUCH NEW COMPOUNDS AND THEIR SALTS AS WELL AS PHARMACEUTICAL PREPARATIONS FOR THERAPEUTIC USE CONTAINING THESE COMPOUNDS OR SALTS PRODES S.A. (ES) 1985-12-27 — — EP disclosed
EP-0089900-A1 New N-((2-oxo-1-pyrrolidinyl)acetyl)piperazines, the methods of producing such new compounds and their salts as well as pharmaceutical preparations for therapeutic use containing these compounds or salts PRODES S.A. (ES) 1983-09-28 — — EP disclosed
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