SCHEMBL6566601

SCHEMBL6566601

COC(=O)c1cc(NC(=O)Nc2ccc(C#N)c(Cl)c2)ccc1OC(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.53
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
CASR P41180 1/20 0.49
MAPT P10636 4/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
IMPDH2 P12268 1/20 0.43
ALDH1A1 P00352 3/20 0.43
RORC P51449 2/20 0.43
S1PR3 Q99500 1/20 0.43
SLC22A12 Q96S37 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 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
SCHEMBL6566722 0.87 MEN1 (0.62) LMNAMEN1KMT2ASMN1; SMN2CASR
SCHEMBL6566851 0.87 MEN1 (0.50) LMNAMEN1KMT2ASMN1; SMN2CASR
SCHEMBL6567772 0.87 MEN1 (0.42) LMNAMEN1KMT2ASMN1; SMN2CASR
SCHEMBL6567728 0.86 MEN1 (0.48) LMNAMEN1KMT2ASMN1; SMN2CASR
SCHEMBL6566855 0.85 MEN1 (0.57) LMNAMEN1KMT2ASMN1; SMN2CASR
SCHEMBL6564600 0.85 MEN1 (0.59) LMNAMEN1KMT2ASMN1; SMN2CASR
SCHEMBL6564786 0.85 KMT2A (0.61) LMNAMEN1KMT2ASMN1; SMN2CASR
SCHEMBL6567047 0.85 MAPT (0.52) LMNAMEN1KMT2ASMN1; SMN2CASR
SCHEMBL6565821 0.85 MEN1 (0.58) LMNAMEN1KMT2ASMN1; SMN2CASR
SCHEMBL6567055 0.83 MEN1 (0.64) LMNAMEN1KMT2ASMN1; SMN2CASR

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 LMNA 4043/4885MEN1 4143/4885KMT2A 3137/4885

“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.