SCHEMBL85993

SCHEMBL85993

COC1Sc2ccccc2C(=O)c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.39
HPGD P15428 3/20 0.39
MAPK1 P28482 3/20 0.39
TSHR P16473 1/20 0.39
EDNRB P24530 3/20 0.38
EDNRA P25101 3/20 0.38
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 4/20 0.37
POLB P06746 4/20 0.37
CDC25B P30305 3/20 0.37
CYP1A2 P05177 2/20 0.37
CDC25A P30304 2/20 0.37
LMNA P02545 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
MAP2K7 O14733 1/20 0.37
GMNN O75496 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL86293 0.77 EDNRB (0.41) MAPTHPGDMAPK1TSHREDNRB
SCHEMBL11570824 0.77 AKR1C3 (0.46) MAPTHPGDTSHRCYP1A2LMNA
SCHEMBL85715 0.75 EDNRB (0.38) MAPTHPGDMAPK1EDNRBEDNRA
SCHEMBL86285 0.74 EDNRB (0.41) MAPTHPGDMAPK1TSHREDNRB
SCHEMBL11493735 0.72 CDC25B (0.46) MAPTHPGDMAPK1EDNRBEDNRA
SCHEMBL11762534 0.70 EDNRB (0.38) MAPTHPGDMAPK1TSHREDNRB
SCHEMBL6901219 0.65 CDC25B (0.52) MAPTHPGDMAPK1EDNRBEDNRA
SCHEMBL6903762 0.65 CDC25B (0.46) MAPTHPGDMAPK1EDNRBEDNRA
SCHEMBL31290856 0.65 MEN1 (0.58) MAPTHPGDMAPK1TSHRKDM4E
SCHEMBL6903914 0.65 MAPK1 (0.67) MAPTMAPK1EDNRBEDNRAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129447-B2 Ink composition and inkjet recording method using the same FUJIFILM CORPORATION (JP) 2012-03-06 US disclosed
US-8129447-B2 Ink composition and inkjet recording method using the same FUJIFILM CORPORATION (JP) 2012-03-06 US disclosed
US-20090087575-A1 INK COMPOSITION AND INKJET RECORDING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed
US-20090087575-A1 INK COMPOSITION AND INKJET RECORDING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2009-04-02 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-20090087575-A1 INK COMPOSITION AND INKJET RECORDING METHOD USING THE SAME RB1, IK, NOX1 MAPT 2087/4885HPGD 2563/4885MAPK1 418/4885

“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.