SCHEMBL11050071

SCHEMBL11050071

CCCCCc1c(CC)oc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.49
EYA3 Q99504 3/20 0.45
CYP2C19 P33261 2/20 0.43
CYP2C9 P11712 1/20 0.43
SLC22A12 Q96S37 1/20 0.42
TTR P02766 1/20 0.41
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41

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
SCHEMBL11218137 0.92 PTPN1 (0.57) PTPN1EYA3TTR
SCHEMBL3261390 0.84 MTNR1A (0.59) PTPN1MTNR1AMTNR1B
SCHEMBL5860509 0.82 EYA3 (0.49) PTPN1EYA3CYP2C19CYP2C9SLC22A12
SCHEMBL2985777 0.81 PTPN1 (0.53) PTPN1EYA3TTR
SCHEMBL14387039 0.80 PTPN1 (0.50) PTPN1EYA3TTR
SCHEMBL6528889 0.80 TLR8 (0.48) PTPN1
SCHEMBL13049676 0.80 PTPN1 (0.55) PTPN1EYA3TTR
SCHEMBL11402772 0.79 PTPN1 (0.50) PTPN1EYA3CYP2C9MTNR1AMTNR1B
SCHEMBL4530526 0.79 SRC (0.52) CYP2C19CYP2C9
SCHEMBL24026894 0.78 PTPN1 (0.51) PTPN1EYA3TTR

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
JP-59204118-A None JP disclosed
JP-S59204118-A BLOOD PLATELET COAGULATION INHIBITING AGENT CONTAINING PYRAZOLE DERIVATIVE AS ACTIVE COMPONENT ZERIA SHINYAKU KOGYO KK 1984-11-19 JP disclosed