SCHEMBL3838703

SCHEMBL3838703

O=C(CN1CCN(CC(=O)c2ccccc2)CC1)NCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.68
USP2 O75604 1/20 0.68
ALDH1A1 P00352 4/20 0.66
KMT2A Q03164 2/20 0.65
MEN1 O00255 1/20 0.65
NPSR1 Q6W5P4 1/20 0.65
MDM2 Q00987 1/20 0.64
GAA P10253 1/20 0.61
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
CA7 P43166 2/20 0.58
CA9 Q16790 2/20 0.58
GFER P55789 1/20 0.56
POLB P06746 1/20 0.55
HTR1A P08908 1/20 0.55
HTR7 P34969 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
MAPT P10636 1/20 0.55
MAPK1 P28482 1/20 0.55

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
SCHEMBL3844592 0.91 HTT (0.79) HTTUSP2ALDH1A1KMT2AMEN1
SCHEMBL3837899 0.91 L3MBTL1 (0.61) HTTUSP2ALDH1A1KMT2AMEN1
SCHEMBL3838145 0.87 LMNA (0.67) HTTUSP2ALDH1A1KMT2AMEN1
SCHEMBL4871531 0.87 LMNA (0.71) HTTUSP2ALDH1A1KMT2AMEN1
Hydrochloric Acid SCHEMBL4873283 0.86 LMNA (0.66) HTTUSP2ALDH1A1KMT2AMEN1
SCHEMBL4818022 0.85 CA1 (0.76) HTTUSP2ALDH1A1KMT2AMEN1
SCHEMBL12359542 0.84 HTT (0.70) HTTUSP2ALDH1A1KMT2AMEN1
SCHEMBL6192050 0.83 KMT2A (0.78) HTTUSP2ALDH1A1KMT2AMEN1
SCHEMBL15307634 0.82 HTT (0.68) HTTUSP2ALDH1A1KMT2AMEN1
SCHEMBL4875267 0.82 ALDH1A1 (0.79) ALDH1A1KMT2AMEN1GFERPOLB

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1553092-B1 ARALKYL FORMYL-ALKYL PIPERAZINE DERIVATIVES AND THEIR USES AS CEREBRAL NERVE PROTECTIVE AGENT SHANGHAI INST PHARM INDUSTRY (CN) 2009-11-04 EP claimed
US-7326710-B2 Aralkyl formyl-alkyl piperazine derivatives and their uses as a cerebral nerve protective agent SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2008-02-05 US claimed
US-20050153981-A1 Aralkyl formly-alkyl piperazine derivatives and their uses as a cerebral nerve protective agent SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2005-07-14 US claimed
EP-1553092-A1 ARALKYL FORMYL-ALKYL PIPERAZINE DERIVATIVES AND THEIR USES AS CEREBRAL NERVE PROTECTIVE AGENT Shanghai Institute of Pharmaceutical Industry (CN) 2005-07-13 EP claimed
EP-1553092-B1 ARALKYL FORMYL-ALKYL PIPERAZINE DERIVATIVES AND THEIR USES AS CEREBRAL NERVE PROTECTIVE AGENT SHANGHAI INST PHARM INDUSTRY (CN) 2009-11-04 EP disclosed
US-7326710-B2 Aralkyl formyl-alkyl piperazine derivatives and their uses as a cerebral nerve protective agent SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2008-02-05 US disclosed
US-20050153981-A1 Aralkyl formly-alkyl piperazine derivatives and their uses as a cerebral nerve protective agent SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2005-07-14 US disclosed
EP-1553092-A1 ARALKYL FORMYL-ALKYL PIPERAZINE DERIVATIVES AND THEIR USES AS CEREBRAL NERVE PROTECTIVE AGENT Shanghai Institute of Pharmaceutical Industry (CN) 2005-07-13 EP 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-20050153981-A1 Aralkyl formly-alkyl piperazine derivatives and their uses as a cerebral nerve protective agent GAP43, FABP7, AGK HTT 627/4885USP2 3273/4885ALDH1A1 1828/4885

“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.