SCHEMBL1861620

SCHEMBL1861620

O=[N+]([O-])c1ccc(O)cc1CNc1c2ccccc2nc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.50
▸ SMN1; SMN2 Q16637 5/20 0.50
▸ MEN1 O00255 5/20 0.50
▸ MAPK1 P28482 4/20 0.50
▸ MAPT P10636 3/20 0.50
▸ RAB9A P51151 3/20 0.50
▸ IDO1 P14902 1/20 0.49
▸ TDO2 P48775 1/20 0.49
▸ POLB P06746 5/20 0.48
▸ RAD52 P43351 3/20 0.48
▸ KDM4E B2RXH2 4/20 0.47
▸ GLA P06280 4/20 0.47
▸ GAA P10253 4/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ EGFR P00533 1/20 0.47
▸ HTT P42858 4/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ LMNA P02545 2/20 0.45
▸ PKM P14618 1/20 0.45

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
SCHEMBL1866907 0.80 KMT2A (0.59) KMT2ASMN1; SMN2MEN1MAPK1MAPT
SCHEMBL1870594 0.72 KMT2A (0.63) KMT2ASMN1; SMN2MEN1MAPK1MAPT
SCHEMBL1589671 0.71 BACE1 (0.50) IDO1TDO2ALDH1A1EGFRNPSR1
SCHEMBL29901077 0.71 BACE1 (0.50) IDO1TDO2ALDH1A1EGFRNPSR1
SCHEMBL27570737 0.71 ALOX5 (0.53) KMT2AMEN1IDO1TDO2ALDH1A1
SCHEMBL12019870 0.71 KMT2A (0.57) KMT2ASMN1; SMN2MEN1MAPK1MAPT
SCHEMBL1863835 0.69 POLB (0.57) KMT2ASMN1; SMN2MEN1MAPK1MAPT
SCHEMBL7518908 0.68 ITGA4 (0.54) ALDH1A1
SCHEMBL7518902 0.68 ITGA4 (0.54) ALDH1A1
SCHEMBL4953327 0.68 BACE1 (0.50) IDO1TDO2POLBALDH1A1EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2493857-A1 9-AMINOACRIDINE DERIVATIVES, THEIR PREPARATION AND USES Ariel-University Research and Development Company Ltd. (IL) 2012-09-05 — — EP claimed
US-20120220537-A1 9-AMINOACRIDINE DERIVATIVES, THEIR PREPARATION AND USES ARIEL-UNIVERSITY RESEARCH AND DEVELOPMENT COMPANY LTD. (IL) 2012-08-30 — — US claimed
WO-2011051950-A1 9-AMINOACRIDINE DERIVATIVES, THEIR PREPARATION AND USES ARIEL-UNIVERSITY RESEARCH AND DEVELOPMENT COMPANY LTD (IL) 2011-05-05 — — WO claimed
EP-2493857-A1 9-AMINOACRIDINE DERIVATIVES, THEIR PREPARATION AND USES Ariel-University Research and Development Company Ltd. (IL) 2012-09-05 — — EP disclosed
US-20120220537-A1 9-AMINOACRIDINE DERIVATIVES, THEIR PREPARATION AND USES ARIEL-UNIVERSITY RESEARCH AND DEVELOPMENT COMPANY LTD. (IL) 2012-08-30 — — US disclosed
US-20120220537-A1 9-AMINOACRIDINE DERIVATIVES, THEIR PREPARATION AND USES ARIEL-UNIVERSITY RESEARCH AND DEVELOPMENT COMPANY LTD. (IL) 2012-08-30 — — US disclosed
US-20120220537-A1 9-AMINOACRIDINE DERIVATIVES, THEIR PREPARATION AND USES ARIEL-UNIVERSITY RESEARCH AND DEVELOPMENT COMPANY LTD. (IL) 2012-08-30 — — US disclosed
WO-2011051950-A1 9-AMINOACRIDINE DERIVATIVES, THEIR PREPARATION AND USES ARIEL-UNIVERSITY RESEARCH AND DEVELOPMENT COMPANY LTD (IL) 2011-05-05 — — WO disclosed
WO-2011051950-A1 9-AMINOACRIDINE DERIVATIVES, THEIR PREPARATION AND USES ARIEL-UNIVERSITY RESEARCH AND DEVELOPMENT COMPANY LTD (IL) 2011-05-05 — — WO 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-20120220537-A1 9-AMINOACRIDINE DERIVATIVES, THEIR PREPARATION AND USES MPG, PRMT9, AADAT KMT2A 848/4885SMN1; SMN2 3075/4885MEN1 1862/4885

“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.

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