SCHEMBL18182000

SCHEMBL18182000

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

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 1/20 0.37
PTGER1 P34995 2/20 0.37
DHODH Q02127 2/20 0.37
PTGER4 P35408 1/20 0.36
PTGER3 P43115 1/20 0.36
PTGER2 P43116 1/20 0.36
MRGPRX4 Q96LA9 2/20 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
SCHEMBL18156316 0.92 PTGER1 (0.38) ALDH1A1RAB9APTGER1PTGER4PTGER3
SCHEMBL18182044 0.91 ACLY (0.34) MAPK14ALDH1A1MAPTPTGER1MRGPRX4
SCHEMBL18182574 0.91 ACLY (0.34) MAPK14ALDH1A1MAPTPTGER1MRGPRX4
SCHEMBL18182642 0.91 PTGER1 (0.38) RAB9APTGER1PTGER4PTGER3PTGER2
SCHEMBL18182021 0.91 PTGER1 (0.38) MAPK14ALDH1A1POLBRAB9AMAPT
SCHEMBL18178568 0.90 PTGER1 (0.38) MAPK14ALDH1A1POLBRAB9AMAPT
SCHEMBL18182931 0.90 ALDH1A1 (0.39) MAPK14ALDH1A1POLBRAB9AMAPT
SCHEMBL18182029 0.90 ALDH1A1 (0.39) ALDH1A1POLBRAB9AMAPTPTGER1
SCHEMBL18156240 0.90 MRGPRX4 (0.40) ALDH1A1POLBRAB9AMAPTPTGER1
SCHEMBL18156164 0.90 ALDH1A1 (0.39) ALDH1A1POLBRAB9AMAPTPTGER1

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 MAPK14 2775/4885ALDH1A1 3176/4885POLB 3778/4885

“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.