SCHEMBL25424005

SCHEMBL25424005

COc1c[nH]nc1C1CC1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.34
PDE10A Q9Y233 4/20 0.33
ABCB1 P08183 1/20 0.33
ADRA1A P35348 2/20 0.33
JUND P17535 1/20 0.31
FOSB P53539 1/20 0.31
PDE3B Q13370 1/20 0.30
PDE3A Q14432 1/20 0.30
CCR2 P41597 1/20 0.30
HTR2A P28223 2/20 0.30
KDM4E B2RXH2 1/20 0.30
PDGFRB P09619 1/20 0.30
PDGFRA P16234 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
SCHEMBL27667136 0.90 PDE10A (0.39) PDE10AABCB1PDE3BPDE3AHTR2A
SCHEMBL17859543 0.74
SCHEMBL22749598 0.71
SCHEMBL4973127 0.70
SCHEMBL719368 0.69 PDK2 (0.39) HTR2CKDM4E
SCHEMBL7839939 0.69
SCHEMBL17881862 0.69
SCHEMBL21001903 0.69 THRB (0.33)
SCHEMBL22089675 0.68 JAK2 (0.36)
SCHEMBL17881944 0.68 PLAT (0.31)

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
WO-2023193760-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN (SHANGHAI) , INC. (CN) 2023-10-12 WO disclosed
WO-2023109954-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2023-06-22 WO disclosed