SCHEMBL10397754

SCHEMBL10397754

CCCCCCCCCCCCCCOc1ccc(-c2ccccc2C(=O)O)cc1

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 6/20 0.74
RARB P10826 3/20 0.63
PLK1 P53350 1/20 0.60
TP53 P04637 1/20 0.60
TSHR P16473 1/20 0.60
PLA2G4B P0C869 5/20 0.58
KDM4E B2RXH2 1/20 0.54
NPC1 O15118 1/20 0.54
ALDH1A1 P00352 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
PLA2G4A P47712 1/20 0.53

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
SCHEMBL9407174 1.00 PTPN11 (0.74) PTPN11RARBPLK1TP53TSHR
SCHEMBL10800801 1.00 PTPN11 (0.74) PTPN11RARBPLK1TP53TSHR
SCHEMBL9723854 1.00 PTPN11 (0.74) PTPN11RARBPLK1TP53TSHR
SCHEMBL8081703 1.00 PTPN11 (0.74) PTPN11RARBPLK1TP53TSHR
SCHEMBL17835424 1.00 PTPN11 (0.74) PTPN11RARBPLK1TP53TSHR
SCHEMBL6265322 1.00 PTPN11 (0.74) PTPN11RARBPLK1TP53TSHR
SCHEMBL6691500 0.99 PTPN11 (0.72) PTPN11RARBPLK1TP53TSHR
SCHEMBL6913917 0.97 PTPN11 (0.70) PTPN11RARBPLK1TP53TSHR
SCHEMBL9187046 0.88 PTPN11 (0.57) PTPN11RARBPLK1TP53TSHR
SCHEMBL9453349 0.88 MEN1 (0.62) PTPN11RARBPLK1TP53TSHR

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-4943386-A FERROELECTRIC, GOOD RESPONSE AND MEMORY DAINIPPON INK & CHEMICALS, INC. (JP) 1990-07-24 US disclosed