SCHEMBL24640700

SCHEMBL24640700

CSN1CCN2c3ncc(Cl)cc3SCC[C@@H]2C1

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
KCNH2 Q12809 2/20 0.30
CHRNA7 P36544 1/20 0.30
HTR3A P46098 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 0.82 HRH3 (0.35) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL24640241 0.82 HRH3 (0.35) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL24640698 0.78
SCHEMBL24639519 0.76 KRAS (0.39)
SCHEMBL24639546 0.76 KRAS (0.39)
SCHEMBL24639545 0.76 KRAS (0.39)
SCHEMBL24640453 0.76 MDM2 (0.42) KDM4EKCNH2
SCHEMBL24640467 0.76 MDM2 (0.42) KDM4EKCNH2
SCHEMBL24640462 0.76 MDM2 (0.42) KDM4EKCNH2
SCHEMBL31244610 0.75 HTR2A (0.47)

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