SCHEMBL18178568

SCHEMBL18178568

CCC(=O)Oc1cccc(Cl)c1COc1cc(F)c(C)cc1Br

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPK14 Q16539 2/20 0.38
POLB P06746 1/20 0.37
RAB9A P51151 1/20 0.37
MAPT P10636 1/20 0.37
DHODH Q02127 2/20 0.36
MRGPRX4 Q96LA9 3/20 0.35
SGMS2 Q8NHU3 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
SCHEMBL18178729 0.91 MRGPRX4 (0.38) PTGER1ALDH1A1RAB9AMRGPRX4
SCHEMBL18182000 0.90 MAPK14 (0.38) PTGER1ALDH1A1MAPK14POLBRAB9A
SCHEMBL18178566 0.90 PTGER1 (0.38) PTGER1MRGPRX4
SCHEMBL18178562 0.90 MRGPRX4 (0.37) PTGER1ALDH1A1RAB9AMAPTMRGPRX4
SCHEMBL18178564 0.90 SLC22A12 (0.39) PTGER1ALDH1A1MAPK14MRGPRX4SGMS2
SCHEMBL18178662 0.90 MRGPRX4 (0.37) PTGER1MAPTMRGPRX4SGMS2
SCHEMBL18178555 0.90 ALDH1A1 (0.39) ALDH1A1POLBRAB9AMAPTDHODH
SCHEMBL18178576 0.90 MRGPRX4 (0.42) PTGER1ALDH1A1POLBRAB9AMAPT
SCHEMBL18178544 0.90 MRGPRX4 (0.40) ALDH1A1POLBRAB9AMAPTDHODH
SCHEMBL18178152 0.89 PTGER1 (0.38) PTGER1ALDH1A1MAPK14POLBRAB9A

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 PTGER1 4234/4885ALDH1A1 3176/4885MAPK14 2775/4885

“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.