SCHEMBL18178055

SCHEMBL18178055

COC(=O)Oc1cccc(CS)c1COc1ccc(C)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 7/20 0.47
PTGER1 P34995 1/20 0.40
PTGER4 P35408 1/20 0.40
PTGER3 P43115 1/20 0.40
PTGER2 P43116 1/20 0.40
RAB9A P51151 4/20 0.40
NPC1 O15118 3/20 0.40
MAPT P10636 4/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
HPGD P15428 3/20 0.39
ATM Q13315 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CD274 Q9NZQ7 4/20 0.38
FABP4 P15090 1/20 0.38
FABP5 Q01469 1/20 0.38
MEN1 O00255 1/20 0.37

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
SCHEMBL18178066 0.91 MRGPRX4 (0.49) MRGPRX4PTGER1PTGER4PTGER3PTGER2
SCHEMBL18178048 0.90 MRGPRX4 (0.48) MRGPRX4PTGER1PTGER4PTGER3PTGER2
SCHEMBL18178459 0.89 MRGPRX4 (0.47) MRGPRX4PTGER1PTGER4PTGER3PTGER2
SCHEMBL18178121 0.89 MRGPRX4 (0.46) MRGPRX4PTGER1PTGER4PTGER3PTGER2
SCHEMBL18178127 0.88 KDM4E (0.42) MRGPRX4PTGER1PTGER4PTGER3PTGER2
SCHEMBL18178362 0.88 FABP4 (0.38) MRGPRX4PTGER1PTGER4PTGER3PTGER2
SCHEMBL18178044 0.88 MRGPRX4 (0.52) MRGPRX4PTGER1PTGER4PTGER3PTGER2
SCHEMBL18178155 0.87 MAPT (0.43) RAB9ANPC1MAPTL3MBTL1HPGD
SCHEMBL18178058 0.87 MRGPRX4 (0.47) MRGPRX4PTGER1PTGER4PTGER3PTGER2
SCHEMBL18178265 0.87 MRGPRX4 (0.39) MRGPRX4RAB9ANPC1MAPTL3MBTL1

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 167/4885PTGER1 4234/4885PTGER4 3370/4885

“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.