SCHEMBL21519447

SCHEMBL21519447

Cc1cc(=O)nc(NN=Cc2c(Cl)cccc2Cl)[nH]1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.52
▸ ALDH1A1 P00352 7/20 0.47
▸ LMNA P02545 3/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ MAPT P10636 5/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.44
▸ GAA P10253 7/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ POLB P06746 3/20 0.42
▸ MEN1 O00255 4/20 0.41
▸ PSMD14 O00487 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ HPGD P15428 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ ALPL P05186 1/20 0.41
▸ ALPI P09923 1/20 0.41

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
SCHEMBL21519445 1.00 KMT2A (0.52) KMT2AALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL21519609 0.92 KMT2A (0.53) KMT2AALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL21519607 0.92 KMT2A (0.53) KMT2AALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL21519374 0.89 KMT2A (0.46) KMT2AALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL21519372 0.89 KMT2A (0.46) KMT2AALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL21519665 0.86 KMT2A (0.58) KMT2AALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL21519664 0.86 KMT2A (0.58) KMT2AALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL21519562 0.86 KMT2A (0.70) KMT2AALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL21519560 0.86 KMT2A (0.70) KMT2AALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL21519616 0.81 MAPT (0.53) KMT2AALDH1A1LMNASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12006294-B2 Therapeutic compounds REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2024-06-11 — — US disclosed
US-20190330157-A1 THERAPEUTIC COMPOUNDS REGENTS OF THE UNIVERSITY OF MINNESOTA 2019-10-31 — — 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 (2 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-20190330157-A1 THERAPEUTIC COMPOUNDS OPRL1, INA, OGFR KMT2A 3083/4885ALDH1A1 1048/4885LMNA 1901/4885
US-12006294-B2 Therapeutic compounds OPRL1, INA, OGFR KMT2A 3083/4885ALDH1A1 1048/4885LMNA 1901/4885

“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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