SCHEMBL6566716

SCHEMBL6566716

COC(=O)c1cc(NC(=O)Nc2ccc(OC)c(OC)c2)ccc1OC(c1ccc(C(F)(F)F)cc1)c1ccccc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.45
MEN1 O00255 6/20 0.43
MAPT P10636 4/20 0.43
ALDH1A1 P00352 3/20 0.43
MAPK1 P28482 3/20 0.43
KDM4E B2RXH2 2/20 0.43
TP53 P04637 1/20 0.43
GAA P10253 1/20 0.43
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
LMNA P02545 5/20 0.42
RAB9A P51151 4/20 0.42
SMN1; SMN2 Q16637 5/20 0.41
NPC1 O15118 1/20 0.41
MCHR1 Q99705 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL6567864 0.93 KMT2A (0.45) KMT2AMEN1MAPTALDH1A1MAPK1
SCHEMBL6564704 0.91 KMT2A (0.48) KMT2AMEN1MAPTALDH1A1MAPK1
SCHEMBL6568020 0.91 KMT2A (0.49) KMT2AMEN1MAPTALDH1A1MAPK1
SCHEMBL6564645 0.90 MEN1 (0.44) KMT2AMEN1MAPTALDH1A1MAPK1
SCHEMBL6564463 0.90 MEN1 (0.47) KMT2AMEN1MAPTALDH1A1MAPK1
SCHEMBL6566690 0.90 KMT2A (0.42) KMT2AMEN1MAPTALDH1A1MAPK1
SCHEMBL6566926 0.90 MEN1 (0.51) KMT2AMEN1MAPTALDH1A1MAPK1
SCHEMBL6565843 0.89 RAB9A (0.47) KMT2AMEN1MAPTALDH1A1MAPK1
SCHEMBL6566643 0.89 KMT2A (0.53) KMT2AMEN1MAPTALDH1A1MAPK1
SCHEMBL6566524 0.88 MEN1 (0.47) KMT2AMEN1MAPTALDH1A1MAPK1

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 4143/4885MAPT 4743/4885

“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.