SCHEMBL18178058

SCHEMBL18178058

COC(=O)Oc1cccc(CS)c1COc1ccc(C)cc1F

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 3/20 0.47
LMNA P02545 4/20 0.37
MAPT P10636 2/20 0.37
CD274 Q9NZQ7 1/20 0.37
ALDH1A1 P00352 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
MAPK1 P28482 1/20 0.37
PTGER1 P34995 3/20 0.36
PTGER4 P35408 2/20 0.36
PTGER3 P43115 2/20 0.36
PTGER2 P43116 2/20 0.36
FFAR1 O14842 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
HTT P42858 2/20 0.35
TDP1 Q9NUW8 1/20 0.34
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL18178117 0.91 MRGPRX4 (0.49) MRGPRX4LMNAMAPTCD274ALDH1A1
SCHEMBL18178046 0.90 MRGPRX4 (0.48) MRGPRX4LMNAMAPTCD274ALDH1A1
SCHEMBL18178450 0.89 MRGPRX4 (0.47) MRGPRX4LMNAMAPTCD274ALDH1A1
SCHEMBL18178121 0.89 MRGPRX4 (0.46) MRGPRX4LMNAMAPTALDH1A1L3MBTL1
SCHEMBL18178127 0.88 KDM4E (0.42) MRGPRX4LMNAMAPTALDH1A1L3MBTL1
SCHEMBL18178349 0.88 MRGPRX4 (0.37) MRGPRX4LMNAMAPTCD274ALDH1A1
SCHEMBL18178045 0.88 MRGPRX4 (0.52) MRGPRX4LMNAMAPTALDH1A1PTGER1
SCHEMBL18178156 0.87 PTGER1 (0.35) MRGPRX4LMNAMAPTALDH1A1L3MBTL1
SCHEMBL18178055 0.87 MRGPRX4 (0.47) MRGPRX4MAPTCD274ALDH1A1L3MBTL1
SCHEMBL18178155 0.87 MAPT (0.43) LMNAMAPTCD274ALDH1A1L3MBTL1

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 MRGPRX4 167/4885LMNA 4171/4885MAPT 4572/4885

“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.