SCHEMBL6566980

SCHEMBL6566980

COC(=O)c1cc(NC(=O)Nc2ccncc2)ccc1OC(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.52
MEN1 O00255 6/20 0.52
LMNA P02545 5/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
RAB9A P51151 2/20 0.48
POLB P06746 1/20 0.48
TAAR1 Q96RJ0 1/20 0.48
ALDH1A1 P00352 3/20 0.47
CASR P41180 1/20 0.46
PKM P14618 1/20 0.44
MAPT P10636 6/20 0.44
GAA P10253 2/20 0.44
HTT P42858 2/20 0.44
RAF1 P04049 1/20 0.43
MDM2 Q00987 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL6564786 0.92 KMT2A (0.61) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL6567721 0.89 KMT2A (0.54) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL6566837 0.89 KMT2A (0.57) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL6565802 0.89 MEN1 (0.54) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL6566734 0.89 MAPT (0.56) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL6566529 0.88 ALDH1A1 (0.56) ALDH1A1CASRHTT
SCHEMBL6566538 0.88 MEN1 (0.56) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL6565992 0.88 MEN1 (0.53) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL6566707 0.88 ALDH1A1 (0.54) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL6564600 0.88 MEN1 (0.59) KMT2AMEN1LMNASMN1; SMN2RAB9A

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-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-12-23 US disclosed
EP-1437344-A1 BENZENE DERIVATIVES,PROCESS FOR PREPARING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2004-07-14 EP 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-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof HRH4, HRH2, HRH1 KMT2A 3137/4885MEN1 4143/4885LMNA 4043/4885

“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.