SCHEMBL7276342

SCHEMBL7276342

CC1Oc2c(C(=O)NC3CC4CCC(C3)N4C)cc(Cl)cc2N(C)C1C

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 5/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
HTR4 Q13639 1/20 0.48
HTR3E A5X5Y0 2/20 0.40
HTR3B O95264 2/20 0.40
HTR3D Q70Z44 2/20 0.40
HTR3C Q8WXA8 2/20 0.40

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
SCHEMBL7270890 0.96 HTR3A (0.48) HTR3AMEN1KMT2AHTR4
SCHEMBL29881195 0.82 HTR3A (0.49) HTR3AMEN1KMT2AHTR4HTR3E
SCHEMBL7280903 0.82 HTR3A (0.49) HTR3AMEN1KMT2AHTR4HTR3E
Hydrochloric Acid SCHEMBL7281701 0.82 HTR3A (0.49) HTR3AMEN1KMT2AHTR4
SCHEMBL8940024 0.79 HTR3A (0.52) HTR3AMEN1KMT2AHTR4HTR3E
SCHEMBL9485758 0.78 HTR3A (0.52) HTR3AMEN1KMT2AHTR4
SCHEMBL7270659 0.78 DRD2 (0.52) HTR3AMEN1KMT2AHTR4
SCHEMBL7271162 0.78 SLC6A12 (0.56) HTR3A
Hydrochloric Acid SCHEMBL9484526 0.78 HTR3A (0.51) HTR3AMEN1KMT2AHTR4
SCHEMBL7270543 0.78 HTR3A (0.64) HTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0407137-B1 Benzazine compounds and pharmaceutical uses thereof YOSHITOMI PHARMACEUTICAL (JP) 1996-05-01 EP disclosed