SCHEMBL9253169

SCHEMBL9253169

O=C1c2ccccc2C(=O)N1CCN1CCC(=C(c2ccc(F)cc2)c2ccc(F)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.54
▸ HIF1A Q16665 2/20 0.54
▸ DGKA P23743 1/20 0.54
▸ DGKG P49619 1/20 0.54
▸ LMNA P02545 2/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ HTR1A P08908 2/20 0.52
▸ TP53 P04637 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ NFKB1 P19838 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ GMNN O75496 1/20 0.51
▸ BLM P54132 1/20 0.51
▸ PMP22 Q01453 1/20 0.51

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
SCHEMBL9253620 0.93 HTR1A (0.51) MAPTHIF1ADGKADGKGLMNA
SCHEMBL9252146 0.89 HTR1A (0.56) ALDH1A1HTR1ATSHR
SCHEMBL9256672 0.82 HTR1A (0.59) HTR1A
SCHEMBL9257110 0.82 HTR1A (0.59) HTR1A
SCHEMBL9232521 0.78 HTR2A (0.67) HIF1ALMNAKDM4ECYP3A4CYP2D6
SCHEMBL9379143 0.76 MAPT (0.49) MAPTHIF1ADGKADGKGLMNA
SCHEMBL31232816 0.76 ADRA1D (0.71) LMNAKDM4EHTR1A
SCHEMBL4419110 0.76 ADRA1D (0.64) —
SCHEMBL23164620 0.75 HTR1A (0.67) HTR1A
SCHEMBL12332512 0.75 HTR1A (0.67) HTR1A

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
US-5470851-A Antihistamine, anticoagulants SANKYO COMPANY, LIMITED (JP) 1995-11-28 — — US disclosed
EP-0463873-A1 Thiazolidinecarboxylic acid amide derivatives having anti-allergic activity, their preparation and their use Sankyo Company Limited (JP) 1992-01-02 — — EP disclosed
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