SCHEMBL18178266

SCHEMBL18178266

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 2/20 0.39
LMNA P02545 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
AKR1C3 P42330 2/20 0.38
SGMS2 Q8NHU3 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ABL1 P00519 2/20 0.37
SRC P12931 2/20 0.37
FABP4 P15090 1/20 0.36
FABP5 Q01469 1/20 0.36
PTGER1 P34995 1/20 0.35
PTGER4 P35408 1/20 0.35
PTGER3 P43115 1/20 0.35
PTGER2 P43116 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
SCHEMBL18178364 0.94 MRGPRX4 (0.38) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL18178268 0.93 NPC1 (0.38) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL18178267 0.93 SLC22A12 (0.39) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL18178262 0.90 SGMS2 (0.39) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL18178277 0.90 LMNA (0.39) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL18178272 0.90 MRGPRX4 (0.37) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL18178269 0.90 KDM4E (0.39) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL18178152 0.90 PTGER1 (0.38) RAB9AALDH1A1SMN1; SMN2LMNASGMS2
SCHEMBL18178261 0.90 NPC1 (0.40) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL18178275 0.90 KDM4E (0.40) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2

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 KDM4E 2107/4885NPC1 1520/4885RAB9A 1136/4885

“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.