SCHEMBL6839352

SCHEMBL6839352

Cc1cccc(Oc2ccc(CBr)cc2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
HTT P42858 2/20 0.53
TDP1 Q9NUW8 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
ACHE P22303 1/20 0.47
FFAR1 O14842 2/20 0.47
HSD17B1 P14061 1/20 0.46
HSD17B2 P37059 1/20 0.46
AR P10275 2/20 0.45
GAA P10253 2/20 0.45
GFER P55789 2/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 1/20 0.42
LYN P07948 1/20 0.42
MAOB P27338 1/20 0.41
MEN1 O00255 1/20 0.41
MITF O75030 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL10877262 0.87 ALDH1A1 (0.53) ALDH1A1HTTTDP1L3MBTL1ACHE
SCHEMBL14159532 0.85 ALDH1A1 (0.65) ALDH1A1HTTTDP1L3MBTL1ACHE
SCHEMBL10013918 0.85 ALDH1A1 (0.65) ALDH1A1HTTTDP1L3MBTL1ACHE
SCHEMBL14159539 0.84 ALDH1A1 (0.80) ALDH1A1HTTTDP1L3MBTL1ACHE
SCHEMBL10013917 0.84 ALDH1A1 (0.80) ALDH1A1HTTTDP1L3MBTL1ACHE
SCHEMBL506995 0.84 ALDH1A1 (0.68) ALDH1A1HTTTDP1L3MBTL1ACHE
SCHEMBL170709 0.84 ALDH1A1 (0.62) ALDH1A1HTTTDP1L3MBTL1ACHE
SCHEMBL9502686 0.82 ALDH1A1 (0.61) ALDH1A1HTTTDP1L3MBTL1ACHE
SCHEMBL260490 0.82 LTA4H (0.63) ALDH1A1HTTTDP1L3MBTL1ACHE
SCHEMBL32670377 0.82 ALDH1A1 (0.61) ALDH1A1HTTTDP1L3MBTL1ACHE

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040142821-A1 Pesticide composition comprising malononitrile compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-07-22 US disclosed
EP-0132606-B1 BENZIMIDAZOLE DERIVATIVES, AND THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-10-07 EP disclosed
EP-0132606-A1 Benzimidazole derivatives, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-02-13 EP 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-20040142821-A1 Pesticide composition comprising malononitrile compounds CBR1, CBR3, ME1 ALDH1A1 867/4885HTT 1113/4885TDP1 2142/4885

“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.