SCHEMBL8747413

SCHEMBL8747413

COCCCCOc1cc(C(=O)O)ccc1-c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.64
KDM4E B2RXH2 6/20 0.57
GAA P10253 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.55
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PDE4A P27815 1/20 0.49
PDE4B Q07343 1/20 0.49
PDE4C Q08493 1/20 0.49
PDE4D Q08499 1/20 0.49
POLB P06746 1/20 0.49
CASP6 P55212 1/20 0.49
RXRA P19793 1/20 0.49
RXRB P28702 1/20 0.49
RXRG P48443 1/20 0.49
CYP11B1 P15538 2/20 0.48
CYP11B2 P19099 2/20 0.48
ALDH1A1 P00352 2/20 0.47
ADRB2 P07550 1/20 0.47

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
SCHEMBL28081727 0.94 EGFR (0.64) EGFRKDM4EGAAL3MBTL1MEN1
SCHEMBL8986588 0.87 PTPN11 (0.60) EGFRALDH1A1
SCHEMBL10871798 0.87 PTPN11 (0.60) EGFRALDH1A1
SCHEMBL4598873 0.87 PTPN11 (0.60) EGFRALDH1A1
SCHEMBL8769895 0.87 PTPN11 (0.60) EGFRALDH1A1
SCHEMBL3976207 0.87 PTPN11 (0.60) EGFRALDH1A1
SCHEMBL6266857 0.87 PTPN11 (0.60) EGFRALDH1A1
Hydrochloric Acid SCHEMBL8419150 0.86 PTPN11 (0.58) EGFRALDH1A1
SCHEMBL31696706 0.86 EGFR (0.53) EGFRKDM4EGAAKMT2APDE4A
SCHEMBL27552279 0.85 KDM4E (0.66) EGFRKDM4ESMN1; SMN2POLBCASP6

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0585032-B1 Anti-ferroelectric liquid crystal and liquid crystal display device MITSUBISHI GAS CHEMICAL CO (JP) 1997-03-05 EP disclosed
US-5340498-A High speed response MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1994-08-23 US disclosed
EP-0585032-A1 Anti-ferroelectric liquid crystal and liquid crystal display device MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1994-03-02 EP disclosed