SCHEMBL24675068

SCHEMBL24675068

CN1CCN2c3ncc(I)cc3N(C)C(=O)CC2C1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.40
HTR2C P28335 2/20 0.40
HTR2B P41595 2/20 0.40
DRD2 P14416 1/20 0.32

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
SCHEMBL24639316 0.85 HTR2A (0.40) HTR2AHTR2CHTR2BDRD2
SCHEMBL24675061 0.77 HTR2A (0.39) HTR2AHTR2CHTR2BDRD2
SCHEMBL24675058 0.77 HTR2A (0.39) HTR2AHTR2CHTR2BDRD2
SCHEMBL24640906 0.76 TIPARP (0.37)
SCHEMBL24640020 0.72 TIPARP (0.38)
SCHEMBL24640039 0.72 TIPARP (0.38)
SCHEMBL24640052 0.72 TIPARP (0.38)
SCHEMBL29088844 0.71 TIPARP (0.42)
SCHEMBL24675043 0.69 HTR2A (0.37) HTR2AHTR2CHTR2B
SCHEMBL24675045 0.69 HTR2A (0.37) HTR2AHTR2CHTR2B

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
WO-2022223022-A1 FUSED-RING HETEROCYCLE DERIVATIVE AND MEDICAL APPLICATION THEREOF 四川海思科制药有限公司 2022-10-27 WO disclosed