SCHEMBL30006748

SCHEMBL30006748

CCCCCCCCCC1=Cc2ccccc2C(=O)C1CCCCCCCCC

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.44
NR1H2 P55055 1/20 0.43
NR1H3 Q13133 1/20 0.43
SOAT1 P35610 4/20 0.36

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
SCHEMBL28240950 0.82 PTPN1 (0.40) PTPN1NR1H2NR1H3SOAT1
SCHEMBL28085412 0.82 PTPN1 (0.40) PTPN1NR1H2NR1H3SOAT1
SCHEMBL4648745 0.81 CYP3A4 (0.40) PTPN1NR1H2NR1H3
SCHEMBL6760415 0.81 CYP3A4 (0.40) PTPN1NR1H2NR1H3
SCHEMBL6057110 0.79 KDM4E (0.41) PTPN1
SCHEMBL15844488 0.76 PTPN1 (0.44) PTPN1NR1H2NR1H3
SCHEMBL15845072 0.76 PTPN1 (0.44) PTPN1NR1H2NR1H3
SCHEMBL1325541 0.76 RAB9A (0.44) PTPN1
SCHEMBL28163615 0.73 KCNH2 (0.38) PTPN1
Benzo[1,2,5]Thiadiazole SCHEMBL2035578 0.72 TLR8 (0.40) PTPN1

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
US-11473032-B2 Constant velocity joint having a boot FUCHS PETROLUB SE (DE) 2022-10-18 US claimed