SCHEMBL6582484

SCHEMBL6582484

FC(F)(F)c1ccc2c(c1)CC(NC1CCN(c3cccc4c3OCCO4)CC1)C2

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
CYP3A4 P08684 1/20 0.47
ALOX12 P18054 1/20 0.47
MAPK1 P28482 1/20 0.47
PMP22 Q01453 1/20 0.47
ADRB1 P08588 1/20 0.44
ADRA1D P25100 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42

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
SCHEMBL6584789 0.86 HTR1A (0.56) HTR1AALDH1A1LMNACYP3A4ALOX12
SCHEMBL6582302 0.84 HTR1A (0.64) HTR1AALDH1A1LMNACYP3A4ALOX12
SCHEMBL6583537 0.84 HTR1A (0.50) HTR1AALDH1A1LMNACYP3A4ALOX12
SCHEMBL6583539 0.84 HTR1A (0.50) HTR1AALDH1A1LMNACYP3A4ALOX12
SCHEMBL6585688 0.84 HTR1A (0.50) HTR1AALDH1A1LMNACYP3A4ALOX12
SCHEMBL6583413 0.82 ADRB1 (0.50) HTR1AALDH1A1LMNACYP3A4ALOX12
SCHEMBL6581590 0.82 HTR1A (0.50) HTR1AALDH1A1LMNACYP3A4ALOX12
SCHEMBL6583374 0.81 HTR1A (0.58) HTR1AALDH1A1LMNACYP3A4ALOX12
SCHEMBL6581720 0.81 HTR1A (0.49) HTR1AALDH1A1LMNACYP3A4ALOX12
SCHEMBL6583373 0.80 HTR1A (0.58) HTR1AALDH1A1LMNACYP3A4ALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0861837-B1 2-Aminoindane derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2004-04-28 EP claimed
EP-0861837-A1 2-Aminoindane derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1998-09-02 EP claimed
EP-0861837-B1 2-Aminoindane derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2004-04-28 EP disclosed
US-5968954-A EXHIBIT SELECTIVE BINDING AFFINITY FOR 5-HYDROXYTRYPTAMINE RECEPTORS ADIR ET COMPAGNIE (FR) 1999-10-19 US disclosed
EP-0861837-A1 2-Aminoindane derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1998-09-02 EP disclosed