SCHEMBL17518045

SCHEMBL17518045

CCCCCCCCOc1cc2c3c(ccc4c5c(OCCCCCCCC)cc6c7c(ccc(c1c34)c75)C(=O)OC6=O)C(=O)OC2=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 1/20 0.43
▸ CDC25B P30305 1/20 0.43
▸ CDC25C P30307 1/20 0.43
▸ PGAM1 P18669 1/20 0.40
▸ LMNA P02545 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ NR1I2 O75469 1/20 0.38
▸ CHRM2 P08172 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ ADRA2A P08913 1/20 0.38
▸ OPRK1 P41145 1/20 0.38
▸ HTR2B P41595 1/20 0.38
▸ SLC6A3 Q01959 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ PTPN11 Q06124 2/20 0.38
▸ SMPD1 P17405 4/20 0.37
▸ LTB4R Q15722 1/20 0.36
▸ KDM4E B2RXH2 1/20 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
SCHEMBL5012564 0.82 PTPN1 (0.43) CDC25ACDC25BCDC25CLMNAMAPT
SCHEMBL4956759 0.80 PTPN1 (0.41) CDC25ACDC25BCDC25CLMNAMAPT
SCHEMBL431062 0.77 PTPN1 (0.43) CDC25ACDC25BCDC25CLMNAMAPT
SCHEMBL28825302 0.77 PTPN1 (0.43) CDC25ACDC25BCDC25CLMNAMAPT
SCHEMBL4951067 0.77 PTPN1 (0.43) CDC25ACDC25BCDC25CLMNAMAPT
SCHEMBL459586 0.77 PTPN1 (0.43) CDC25ACDC25BCDC25CLMNAMAPT
SCHEMBL29537915 0.77 PTPN1 (0.43) CDC25ACDC25BCDC25CLMNAMAPT
SCHEMBL17190544 0.75 STAT3 (0.46) CDC25ALMNAMAPTMEN1KMT2A
SCHEMBL14706353 0.74 MAPT (0.38) LMNAMAPTMEN1NR1I2CHRM2
SCHEMBL14706336 0.74 PPARG (0.36) LMNAMAPTMEN1NR1I2CHRM2

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-20160043328-A1 ORGANIC COMPOUND AND PHOTOVOLTAIC DEVICE COMPRISING THE SAME CRYSCADE SOLAR LIMITED (CY) 2016-02-11 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160043328-A1 ORGANIC COMPOUND AND PHOTOVOLTAIC DEVICE COMPRISING THE SAME CORO1C, SUN2, VDAC1 CDC25A 2964/4885CDC25B 2446/4885CDC25C 2627/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback