SCHEMBL1445489

SCHEMBL1445489

Cc1cc(C)c(NC(=O)C(C)C)c(C)c1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.40
NPSR1 Q6W5P4 1/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 5/20 0.36
KDM4E B2RXH2 3/20 0.36
GLA P06280 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
MDM4 O15151 1/20 0.35
TP53 P04637 1/20 0.35
LCK P06239 1/20 0.34
LMNA P02545 3/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL19299630 0.84 MAOB (0.42) MAOBNPSR1KMT2AALDH1A1KDM4E
SCHEMBL1445721 0.80 ALDH1A1 (0.47) MAOBALDH1A1KDM4ELCKLMNA
SCHEMBL16086041 0.77 NPSR1 (0.38) MAOBNPSR1KMT2AALDH1A1KDM4E
SCHEMBL14667355 0.76 HTT (0.53) NPSR1ALDH1A1KDM4ECA12CA1
SCHEMBL14671037 0.76 TSHR (0.53) MAOBALDH1A1KDM4ELMNAMAPT
SCHEMBL14519900 0.76 ALDH1A1 (0.57) MAOBNPSR1KMT2AALDH1A1LCK
SCHEMBL12489653 0.75 LMNA (0.41) KMT2AALDH1A1CA1CA2LMNA
SCHEMBL15401983 0.73 CYP2C19 (0.46) ALDH1A1KDM4ETP53LMNAMAPT
SCHEMBL19283203 0.73 ALDH1A1 (0.58) MAOBNPSR1KMT2AALDH1A1KDM4E
SCHEMBL22430504 0.73 KMT2A (0.44) MAOBNPSR1KMT2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9670364-B2 Compound having xanthene skeleton, colorant composition, ink for inkjet recording, inkjet recording method, inkjet printer cartridge, and inkjet recording material FUJIFILM CORPORATION (JP) 2017-06-06 US disclosed
US-20160208102-A1 COMPOUND HAVING XANTHENE SKELETON, COLORANT COMPOSITION, INK FOR INKJET RECORDING, INKJET RECORDING METHOD, INKJET PRINTER CARTRIDGE, AND INKJET RECORDING MATERIAL FUJIFILM CORPORATION (JP) 2016-07-21 US disclosed
US-20140004458-A1 MAGENTA TONER CANON KABUSHIKI KAISHA (JP) 2014-01-02 US disclosed
US-8343269-B2 Colorant compound CANON KABUSHIKI KAISHA (JP) 2013-01-01 US disclosed
EP-2302001-B1 Xanthene-based colorant compound CANON KK (JP) 2012-12-05 EP disclosed
EP-2302001-A1 Xanthene-based colorant compound Canon Kabushiki Kaisha (JP) 2011-03-30 EP disclosed
US-20110067598-A1 COLORANT COMPOUND CANON KABUSHIKI KAISHA (JP) 2011-03-24 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-20110067598-A1 COLORANT COMPOUND CNOT9, RB1, PRMT9 MAOB 173/4885NPSR1 3044/4885KMT2A 1113/4885

“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.