SCHEMBL6567679

SCHEMBL6567679

CCC(=O)c1cc(N)ccc1OCc1ccccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.47
FFAR1 O14842 1/20 0.47
FFAR4 Q5NUL3 1/20 0.47
HTT P42858 2/20 0.45
TP53 P04637 1/20 0.45
TRPM8 Q7Z2W7 2/20 0.44
FABP4 P15090 1/20 0.44
FABP5 Q01469 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
MCL1 Q07820 1/20 0.44
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 2/20 0.43
S1PR4 O95977 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
S1PR1 P21453 1/20 0.43

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
SCHEMBL6564873 0.81 KMT2A (0.51) HDAC8FFAR1FFAR4RAB9ASMN1; SMN2
SCHEMBL14855083 0.78 IDO1 (0.50) HDAC8FFAR1FFAR4HTTTP53
SCHEMBL6565713 0.78 KDM4A (0.39) FFAR1FFAR4MRGPRX4MAPTALDH1A1
SCHEMBL6566551 0.78 SMN1; SMN2 (0.49) FFAR1FFAR4HTTMRGPRX4RAB9A
SCHEMBL6567981 0.77 HDAC8 (0.53) HDAC8TP53RAB9ASMN1; SMN2MAPT
SCHEMBL6564598 0.76 SMN1; SMN2 (0.48) HTTRAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL6565808 0.75 KMT2A (0.46) FFAR1FFAR4MAOBRAB9ASMN1; SMN2
SCHEMBL6564400 0.75 PDK2 (0.47) MRGPRX4RAB9ASMN1; SMN2MAPTHPGD
SCHEMBL6566584 0.74 PTGER3 (0.52) HDAC8TP53RAB9ASMN1; SMN2MAPT
SCHEMBL6568009 0.74 PTGDR2 (0.55) HTTTP53SMN1; SMN2MAPTALDH1A1

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 HDAC8 701/4885FFAR1 221/4885FFAR4 190/4885

“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.