SCHEMBL9631996

SCHEMBL9631996

Fc1ccc(C2(c3ccc(F)cc3)C3CCN2CC3)cc1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.39
MAOA P21397 1/20 0.39
HSD11B1 P28845 7/20 0.37
ATM Q13315 1/20 0.34
POLB P06746 1/20 0.34
NPY1R P25929 1/20 0.34

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
SCHEMBL9379001 0.65 MAOB (0.41) MAOBMAOANPY1R
SCHEMBL6901583 0.64 KMT2A (0.63)
SCHEMBL2173396 0.61 MAOB (0.41) MAOBMAOAHSD11B1
SCHEMBL23672519 0.60 MAOB (0.39) MAOBMAOAHSD11B1
SCHEMBL23595712 0.59 SLC6A3 (0.61)
SCHEMBL121601 0.59 HSD11B1 (0.46) MAOBMAOAHSD11B1
SCHEMBL4087444 0.58 MAOB (0.46) MAOBMAOAHSD11B1
SCHEMBL23293520 0.58 SLC6A9 (0.43)
SCHEMBL13221434 0.57 MAOB (0.50) MAOBMAOAHSD11B1POLB
SCHEMBL426911 0.57 SLC6A9 (0.45) HSD11B1

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