SCHEMBL18749644

SCHEMBL18749644

CNC(=O)Cc1ccccc1COc1cc(C)c(C)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 2/20 0.43
▸ FFAR1 O14842 1/20 0.43
▸ FFAR4 Q5NUL3 1/20 0.43
▸ MRGPRX4 Q96LA9 3/20 0.42
▸ PTGDR2 Q9Y5Y4 1/20 0.42
▸ ANO1 Q5XXA6 2/20 0.41
▸ CD274 Q9NZQ7 7/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ FABP4 P15090 1/20 0.40
▸ FABP5 Q01469 1/20 0.40
▸ ANO2 Q9NQ90 1/20 0.39

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
SCHEMBL18515235 0.91 HDAC8 (0.41) HDAC8FFAR1FFAR4MRGPRX4PTGDR2
SCHEMBL18749866 0.88 MAPT (0.46) FFAR1FFAR4PTGDR2ANO1CD274
SCHEMBL18749647 0.86 SLC22A12 (0.43) HDAC8FFAR1FFAR4MRGPRX4ANO1
SCHEMBL18749859 0.86 KMT2A (0.41) HDAC8FFAR1FFAR4MRGPRX4ANO1
SCHEMBL18749696 0.86 MRGPRX4 (0.50) HDAC8FFAR1FFAR4MRGPRX4CD274
SCHEMBL18749633 0.86 MRGPRX4 (0.38) HDAC8FFAR1FFAR4MRGPRX4ANO1
SCHEMBL18749543 0.86 LMNA (0.44) HDAC8FFAR1FFAR4MRGPRX4PTGDR2
SCHEMBL18749980 0.85 MRGPRX4 (0.40) HDAC8FFAR1FFAR4MRGPRX4ANO1
SCHEMBL18749695 0.85 MCL1 (0.43) MRGPRX4PTGDR2CD274TP53HTT
SCHEMBL18749701 0.84 MRGPRX4 (0.38) HDAC8MRGPRX4ANO1CD274

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9907307-B2 Aromatic compound and uses thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-03-06 — — US disclosed
US-9788547-B2 Aromatic compound and uses thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-17 — — US disclosed
US-20170105413-A1 AROMATIC COMPOUND AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-20 — — US disclosed
US-20170105416-A1 AROMATIC COMPOUND AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-20 — — US 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 (2 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-20170105413-A1 AROMATIC COMPOUND AND USES THEREOF TYR, H1-3, H1-0 HDAC8 1071/4885FFAR1 3450/4885FFAR4 4194/4885
US-20170105416-A1 AROMATIC COMPOUND AND USES THEREOF TYR, H1-3, H1-10 HDAC8 1611/4885FFAR1 3287/4885FFAR4 4026/4885

“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.

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