SCHEMBL11034686

SCHEMBL11034686

NC(=O)COCCOCCN1CCC(=Cc2ccccc2-c2ccc(Cl)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
HRH1 P35367 5/20 0.41
TDP1 Q9NUW8 3/20 0.41
HTR2A P28223 3/20 0.41
DRD3 P35462 3/20 0.41
HTR2B P41595 3/20 0.41
HRH2 P25021 2/20 0.41
KCNH2 Q12809 2/20 0.41
USP2 O75604 2/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
TEK Q02763 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 4/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
POLB P06746 1/20 0.38
DRD2 P14416 2/20 0.38

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
SCHEMBL11287903 0.98 HRH1 (0.42) KDM4EHRH1TDP1HTR2ADRD3
Hydrochloric Acid SCHEMBL11036483 0.97 HRH1 (0.43) KDM4EHRH1TDP1HTR2ADRD3
SCHEMBL11037054 0.91 HRH1 (0.51) KDM4EHRH1TDP1HTR2ADRD3
Hydrochloric Acid SCHEMBL11035291 0.90 HRH1 (0.52) KDM4EHRH1TDP1HTR2ADRD3
SCHEMBL11036104 0.88 KDM4E (0.41) KDM4ETDP1DRD3MEN1KMT2A
Hydrochloric Acid SCHEMBL11034941 0.88 HRH1 (0.53) KDM4EHRH1TDP1HTR2ADRD3
SCHEMBL11037599 0.86 HTR7 (0.41) DRD3KCNH2MEN1KMT2APOLB
SCHEMBL11100917 0.86 SCN9A (0.37) HRH1TDP1HTR2ADRD3HTR2B
Hydrochloric Acid SCHEMBL11037586 0.85 HTR7 (0.41) DRD3KCNH2MEN1KMT2APOLB
Hydrochloric Acid SCHEMBL11034454 0.85 HRH1 (0.38) HRH1TDP1HTR2ADRD3HTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0048705-B1 2-(4-(DIPHENYLMETHYLENE)-1-PIPERIDINYL)-ACETIC ACIDS AND THEIR AMIDES, THEIR PREPARATION AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM U C B, S.A. (BE) 1984-07-11 EP disclosed
US-4443460-A ANTIALLERGENS, ANTIHISTAMINES, ANTISPASMODICS, BRONCHODILATORS UCB, SOCIETE ANONYME (BE) 1984-04-17 US disclosed
EP-0048705-A1 2-(4-(Diphenylmethylene)-1-piperidinyl)-acetic acids and their amides, their preparation and pharmaceutical preparations containing them U C B, S.A. (BE) 1982-03-31 EP disclosed