SCHEMBL18178262

SCHEMBL18178262

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

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SGMS2 Q8NHU3 1/20 0.39
PTGER1 P34995 2/20 0.38
DHODH Q02127 4/20 0.38
ALDH1A1 P00352 3/20 0.37
RAB9A P51151 2/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
NPSR1 Q6W5P4 1/20 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
SCHEMBL18178363 0.91 PTGER1 (0.40) PTGER1SMN1; SMN2KDM4E
SCHEMBL18178274 0.90 SGMS2 (0.41) SGMS2PTGER1DHODHALDH1A1RAB9A
SCHEMBL18178254 0.90 SGMS2 (0.41) SGMS2DHODHALDH1A1RAB9APOLB
SCHEMBL18178243 0.90 SGMS2 (0.41) SGMS2DHODHALDH1A1RAB9APOLB
SCHEMBL18178267 0.90 SLC22A12 (0.39) SGMS2ALDH1A1RAB9ASMN1; SMN2LMNA
SCHEMBL18178150 0.90 PTGER1 (0.40) PTGER1KDM4E
SCHEMBL18178268 0.90 NPC1 (0.38) ALDH1A1RAB9ASMN1; SMN2LMNAKDM4E
SCHEMBL18178266 0.90 KDM4E (0.39) SGMS2PTGER1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL18178666 0.89 PTGER1 (0.38) SGMS2PTGER1DHODHALDH1A1RAB9A
SCHEMBL18182162 0.88 SGMS2 (0.39) SGMS2PTGER1DHODHALDH1A1RAB9A

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 SGMS2 1962/4885PTGER1 4234/4885DHODH 4210/4885

“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.