SCHEMBL86350

SCHEMBL86350

O=C(O)Cc1ccc2c(c1)C(=O)c1ccccc1SC2

nearest known ligand 0.81

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 4/20 0.77
NOTUM Q6P988 1/20 0.45
MAPT P10636 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
FNTA P49354 1/20 0.39
FNTB P49356 1/20 0.39
PKLR P30613 1/20 0.39
MAPK14 Q16539 1/20 0.39

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
SCHEMBL86394 0.90 AKR1B1 (0.81) AKR1B1NOTUMMAPTSMN1; SMN2MAPK14
SCHEMBL38906 0.90 AKR1B1 (0.81) AKR1B1NOTUMMAPK14
Tiopinac SCHEMBL38905 0.87 AKR1B1 (1.00) AKR1B1NOTUMMAPK14
SCHEMBL11865994 0.85 AKR1B1 (0.62) AKR1B1MAPTMAPK14
SCHEMBL11871415 0.84 AKR1B1 (0.58) AKR1B1NOTUMMAPT
SCHEMBL11863037 0.84 AKR1B1 (0.58) AKR1B1MAPT
Hydrochloric Acid SCHEMBL11867551 0.83 AKR1B1 (0.57) AKR1B1NOTUMMAPT
Tiopinac SCHEMBL11569336 0.81 AKR1B1 (0.86) AKR1B1PKLRMAPK14
SCHEMBL11871128 0.81 AKR1B1 (0.55) AKR1B1
SCHEMBL86351 0.80 TTR (0.55) AKR1B1NOTUM

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 AKR1B1 1704/4885NOTUM 3865/4885MAPT 2087/4885

“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.