SCHEMBL18178960

SCHEMBL18178960

CNC(=O)Oc1cccc(C)c1COc1cc(C)c(C)cc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 2/20 0.46
MAPT P10636 2/20 0.44
RAB9A P51151 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALDH1A1 P00352 5/20 0.43
PGR P06401 1/20 0.43
GAA P10253 1/20 0.43
PTGS1 P23219 1/20 0.43
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ACHE P22303 1/20 0.40
SGMS2 Q8NHU3 1/20 0.39
CYP1A2 P05177 1/20 0.39
LMNA P02545 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37

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
SCHEMBL18182549 0.90 SLC22A12 (0.43) SLC22A12MAPTRAB9ANPSR1ALDH1A1
SCHEMBL18178967 0.89 MAPT (0.42) SLC22A12MAPTRAB9ANPSR1ALDH1A1
SCHEMBL18178963 0.89 MAPT (0.42) SLC22A12MAPTRAB9ANPSR1ALDH1A1
SCHEMBL18178959 0.89 MAPT (0.42) SLC22A12MAPTRAB9ANPSR1ALDH1A1
SCHEMBL18178955 0.89 RAB9A (0.42) SLC22A12MAPTRAB9ANPSR1ALDH1A1
SCHEMBL18178958 0.89 MRGPRX4 (0.42) SLC22A12MAPTRAB9ANPSR1ALDH1A1
SCHEMBL18178962 0.89 MAPT (0.42) SLC22A12MAPTRAB9ANPSR1ALDH1A1
SCHEMBL18178961 0.88 ALDH1A1 (0.43) SLC22A12MAPTRAB9ANPSR1ALDH1A1
SCHEMBL18178841 0.87 MRGPRX4 (0.49) SLC22A12MAPTRAB9AALDH1A1PGR
SCHEMBL18178969 0.87 MAPT (0.40) SLC22A12MAPTRAB9ANPSR1ALDH1A1

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 SLC22A12 4500/4885MAPT 4572/4885RAB9A 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.