SCHEMBL4497794

SCHEMBL4497794

COc1cc(N)c(Cl)cc1C(=O)N[C@@H]1CCN(CC2CCN(C(=O)C(C)C)CC2)CC1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 17/20 1.00
KCNH2 Q12809 6/20 0.85

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
SCHEMBL3316732 1.00 HTR4 (1.00) HTR4KCNH2
SCHEMBL4476539 1.00 HTR4 (1.00) HTR4KCNH2
SCHEMBL3314658 1.00 HTR4 (1.00) HTR4KCNH2
SCHEMBL3314657 1.00 HTR4 (1.00) HTR4KCNH2
Hydrochloric Acid SCHEMBL3316620 0.99 HTR4 (0.98) HTR4KCNH2
Hydrochloric Acid SCHEMBL3316629 0.99 HTR4 (0.98) HTR4KCNH2
Hydrochloric Acid SCHEMBL3316618 0.99 HTR4 (0.98) HTR4KCNH2
Maleic Acid SCHEMBL3314014 0.95 HTR4 (0.91) HTR4KCNH2
Fumaric Acid SCHEMBL3314024 0.95 HTR4 (0.91) HTR4KCNH2
Fumaric Acid SCHEMBL3314020 0.95 HTR4 (0.91) HTR4KCNH2

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
EP-2137152-A1 NOVEL BENZAMIDE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Dong-A Pharm.Co., Ltd. (KR) 2009-12-30 EP claimed
WO-2008114971-A1 NOVEL BENZAMIDE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF DONG-A PHARM. CO., LTD. (KR) 2008-09-25 WO claimed