SCHEMBL9632755

SCHEMBL9632755

OC(CC1CCN(Cc2ccccc2)C1)(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.51
BCHE P06276 2/20 0.51
BACE1 P56817 2/20 0.51
CHRM4 P08173 1/20 0.51
SLC6A3 Q01959 2/20 0.50
SLC6A4 P31645 1/20 0.50
DRD2 P14416 1/20 0.50
DRD4 P21917 1/20 0.50
SLC6A12 P48065 1/20 0.49
TMEM97 Q5BJF2 1/20 0.49
MCHR1 Q99705 1/20 0.49
SIGMAR1 Q99720 1/20 0.49

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
Hydrochloric Acid SCHEMBL9631980 0.92 ALDH1A1 (0.50) ACHEBCHEBACE1DRD2DRD4
Water SCHEMBL10719501 0.83 BCHE (0.49) ACHEBCHEBACE1SLC6A3SLC6A4
SCHEMBL10519952 0.83 CCR3 (0.59) ACHEBCHE
SCHEMBL7365667 0.80 DRD2 (0.50) CHRM4DRD2SIGMAR1
SCHEMBL10460719 0.80 KCNH2 (0.59) ACHEBCHEBACE1DRD2DRD4
SCHEMBL28657725 0.78 CCR3 (0.57) ACHEBCHEBACE1
SCHEMBL9426679 0.77 ACHE (0.49) ACHEBCHEBACE1CHRM4SIGMAR1
SCHEMBL803083 0.77 CCR3 (0.58) ACHEBCHEBACE1
SCHEMBL7442047 0.76 KCNH2 (0.69) ACHEBCHEBACE1SLC6A12TMEM97
SCHEMBL7366392 0.76 DRD2 (0.55) CHRM4DRD2SIGMAR1

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
US-5079249-A Serotine antagonists at 5-HT2 level, antiallergens, antihistamines ADIR ET COMPAGNIE (FR) 1992-01-07 US disclosed
US-5071847-A BIS (ARYL) ALKENE COMPOUNDS OF HOMOPIPERIDINES USEFUL AS SEROTONIN-ANTAGONISTS ADIR ET COMPAGNIE (FR) 1991-12-10 US disclosed
US-5028607-A Antiserotonine agents ADIR ET COMPAGNIE (FR) 1991-07-02 US disclosed