SCHEMBL85938

SCHEMBL85938

C=CC(=O)N1Cc2ccc(Cl)cc2C(=O)c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 9/20 0.41
ACHE P22303 3/20 0.41
KCNN4 O15554 1/20 0.41
KCNA3 P22001 1/20 0.41
PAX8 Q06710 1/20 0.39
GSK3B P49841 2/20 0.38
S100A4 P26447 1/20 0.37
NOTUM Q6P988 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
SCHEMBL87091 0.80 S100A4 (0.41) HSD17B3KCNN4KCNA3S100A4
SCHEMBL86309 0.75 S100A4 (0.44) HSD17B3KCNN4KCNA3S100A4
SCHEMBL86823 0.70 RAB9A (0.44) HSD17B3ACHEPAX8GSK3BNOTUM
SCHEMBL91647 0.68 ALDH1A1 (0.42) S100A4
SCHEMBL31562020 0.66 LMNA (0.66) GSK3BNOTUM
SCHEMBL6387824 0.66 L3MBTL1 (0.64) S100A4
SCHEMBL6899110 0.66 MAOA (0.67) S100A4
SCHEMBL11145884 0.64 MAOA (0.57) S100A4
SCHEMBL18533257 0.63 HDAC1 (0.56) HSD17B3NOTUM
SCHEMBL16559383 0.63 F7 (0.58) S100A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2053095-B1 Ink composition and inkjet recording method using the same FUJIFILM CORP (JP) 2014-03-26 EP disclosed
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
EP-2053095-A2 Ink composition and inkjet recording method using the same Fujifilm Corporation (JP) 2009-04-29 EP 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 HSD17B3 1694/4885ACHE 911/4885KCNN4 386/4885

“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.