SCHEMBL18178504

SCHEMBL18178504

CCC(=O)Oc1cccc(Cl)c1COc1ccc(C)cc1C(F)F

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 3/20 0.40
PTGER1 P34995 1/20 0.40
PTGER4 P35408 1/20 0.40
PTGER3 P43115 1/20 0.40
PTGER2 P43116 1/20 0.40
MAPT P10636 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
RAB9A P51151 1/20 0.37
ATM Q13315 1/20 0.37
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 1/20 0.35
POLB P06746 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LTB4R Q15722 1/20 0.35
LTB4R2 Q9NPC1 1/20 0.35

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
SCHEMBL18178112 0.89 MRGPRX4 (0.40) MRGPRX4PTGER1PTGER4PTGER3PTGER2
SCHEMBL18178500 0.89 SLC22A12 (0.39) MRGPRX4MAPTL3MBTL1RAB9AALDH1A1
SCHEMBL18178508 0.89 MRGPRX4 (0.37) MRGPRX4MAPTL3MBTL1RAB9AATM
SCHEMBL18182567 0.88 ALOX15 (0.38) MRGPRX4MAPTL3MBTL1RAB9AATM
SCHEMBL18178503 0.88 MRGPRX4 (0.41) MRGPRX4PTGER1MAPTLTB4RLTB4R2
SCHEMBL18178505 0.88 KDM4E (0.37) MRGPRX4PTGER1PTGER4PTGER3PTGER2
SCHEMBL18178771 0.88 MRGPRX4 (0.37) MRGPRX4PTGER1PTGER4PTGER3PTGER2
SCHEMBL18178453 0.88 MRGPRX4 (0.52) MRGPRX4PTGER1PTGER4PTGER3PTGER2
SCHEMBL18178502 0.87 MRGPRX4 (0.35) MRGPRX4MAPTL3MBTL1RAB9AALDH1A1
SCHEMBL18178499 0.87 MAPT (0.37) MRGPRX4MAPTL3MBTL1RAB9AALDH1A1

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.