SCHEMBL6567513

SCHEMBL6567513

CCC(=O)c1cccc(NC(=O)Nc2cccc(OC)c2)c1OC(c1ccccc1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.53
ALDH1A1 P00352 3/20 0.53
HTT P42858 2/20 0.53
MAPT P10636 6/20 0.52
MEN1 O00255 6/20 0.52
KMT2A Q03164 6/20 0.52
CASR P41180 1/20 0.52
KDM4E B2RXH2 2/20 0.49
PTGER3 P43115 1/20 0.48
GRIK1 P39086 1/20 0.48
NPC1 O15118 3/20 0.48
TSHR P16473 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MITF O75030 1/20 0.47
TP53 P04637 1/20 0.47
TRPV1 Q8NER1 1/20 0.46
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
SCHEMBL6564390 0.90 PKM (0.53) RAB9AALDH1A1HTTMAPTMEN1
SCHEMBL6564529 0.87 MEN1 (0.56) RAB9AALDH1A1MAPTMEN1KMT2A
SCHEMBL6567509 0.84 CASR (0.53) RAB9AALDH1A1HTTMAPTMEN1
SCHEMBL6567518 0.83 MAPT (0.53) RAB9AALDH1A1HTTMAPTMEN1
SCHEMBL1463228 0.76 GRIK1 (0.73) RAB9AALDH1A1HTTMAPTMEN1
SCHEMBL6564383 0.76 CASR (0.50) RAB9AHTTMAPTMEN1KMT2A
SCHEMBL6564574 0.74 TSHR (0.55) RAB9AALDH1A1HTTMAPTMEN1
SCHEMBL6564596 0.74 TSHR (0.55) RAB9AALDH1A1HTTMAPTMEN1
SCHEMBL6565854 0.73 KMT2A (0.46) RAB9AALDH1A1HTTMAPTMEN1
SCHEMBL6564396 0.73 SAE1 (0.56) RAB9AALDH1A1HTTMAPTMEN1

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 RAB9A 1322/4885ALDH1A1 907/4885HTT 2150/4885

“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.