SCHEMBL18178408

SCHEMBL18178408

COC(=O)Oc1ccccc1COc1cc(C)c(C)cc1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.46
FFAR1 O14842 2/20 0.46
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MRGPRX4 Q96LA9 6/20 0.40
MAOB P27338 2/20 0.40
MAOA P21397 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
SGMS2 Q8NHU3 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
PARP14 Q460N5 1/20 0.37
PARP10 Q53GL7 1/20 0.37
ATM Q13315 1/20 0.37
SGPL1 O95470 1/20 0.36

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
SCHEMBL18182222 0.92 FFAR4 (0.43) FFAR4FFAR1MEN1KMT2AMRGPRX4
SCHEMBL18178209 0.92 FFAR4 (0.43) FFAR4FFAR1MEN1KMT2AMRGPRX4
SCHEMBL18178311 0.91 MRGPRX4 (0.44) FFAR4FFAR1MEN1KMT2AMRGPRX4
SCHEMBL18178787 0.88 FFAR4 (0.46) FFAR4FFAR1MEN1KMT2AMRGPRX4
SCHEMBL18178157 0.87 FFAR4 (0.45) FFAR4FFAR1MRGPRX4MAOBMAOA
SCHEMBL18178413 0.86 MRGPRX4 (0.39) FFAR4FFAR1MEN1KMT2AMRGPRX4
SCHEMBL18178424 0.85 MRGPRX4 (0.38) FFAR4FFAR1MEN1KMT2AMRGPRX4
SCHEMBL18182759 0.85 PARP14 (0.39) FFAR4FFAR1MRGPRX4MAOBMAOA
SCHEMBL18178375 0.85 PTGDR2 (0.47) FFAR4FFAR1PTGDR2KDM4EHPGD
SCHEMBL18178411 0.85 MRGPRX4 (0.40) FFAR4FFAR1MEN1KMT2AMRGPRX4

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-9573904-B2 Aromatic compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-21 US disclosed
US-20160311775-A1 AROMATIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-10-27 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 (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-20160311775-A1 AROMATIC COMPOUND AND USE THEREOF ZCCHC8, CBR3, CBX8 FFAR4 2485/4885FFAR1 2736/4885MEN1 3638/4885

“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.