SCHEMBL24640236

SCHEMBL24640236

CC(C)N1CCN2c3ncc(Cl)cc3SCC2C1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.32
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
KMT2A Q03164 1/20 0.30
HSD17B10 Q99714 1/20 0.30
KCNN4 O15554 1/20 0.30
MDM2 Q00987 1/20 0.30

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
SCHEMBL24640705 0.88 HRH3 (0.35) HRH3KDM4EMEN1ALDH1A1MAPT
SCHEMBL24640241 0.88 HRH3 (0.35) HRH3KDM4EMEN1ALDH1A1MAPT
SCHEMBL24640240 0.83 HRH3 (0.36) HRH3MDM2
SCHEMBL24640235 0.83 HRH3 (0.33) HRH3
SCHEMBL24640200 0.83 HRH3 (0.36) HRH3MDM2
SCHEMBL24640238 0.82 DRD2 (0.35) HRH3
SCHEMBL24640697 0.82 HRH3 (0.31) HRH3
SCHEMBL24640186 0.79
SCHEMBL24640782 0.77 HRH3 (0.37) HRH3KMT2AKCNN4
SCHEMBL24640776 0.77 HRH3 (0.37) HRH3KMT2AKCNN4

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-2022170974-A1 TRICYCLIC DERIVATIVES USEFUL AS PARP7 INHIBITORS JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2022-08-18 WO disclosed