SCHEMBL3787589

SCHEMBL3787589

Nc1ccccc1-c1ccccc1OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.54
LTA4H P09960 1/20 0.54
MAPK14 Q16539 1/20 0.54
BRD4 O60885 4/20 0.53
L3MBTL1 Q9Y468 3/20 0.52
MAPT P10636 2/20 0.52
MAPK1 P28482 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
PTGER1 P34995 5/20 0.50
IDO1 P14902 1/20 0.50
HTR1A P08908 1/20 0.49
DRD2 P14416 1/20 0.49
ALDH1A1 P00352 1/20 0.48
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
RXRG P48443 1/20 0.47
LIPE Q05469 1/20 0.47
GAA P10253 1/20 0.47
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47

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
SCHEMBL26013299 0.88 MAPT (0.63) LTA4HMAPK14BRD4L3MBTL1MAPT
SCHEMBL3785825 0.88 L3MBTL1 (0.51) APPLTA4HMAPK14BRD4L3MBTL1
SCHEMBL3793676 0.85 CYP19A1 (0.59) APPLTA4HMAPK14BRD4L3MBTL1
SCHEMBL3789461 0.85 CYP19A1 (0.49) APPLTA4HMAPK14BRD4L3MBTL1
SCHEMBL3792054 0.84 MAPT (0.51) APPLTA4HMAPK14BRD4L3MBTL1
SCHEMBL292275 0.84 APP (0.72) APPLTA4HMAPK14L3MBTL1MAPT
SCHEMBL6430443 0.82 PTGER1 (0.53) LTA4HMAPK14BRD4PTGER1
Hydrochloric Acid SCHEMBL584918 0.82 APP (0.70) APPLTA4HMAPK14L3MBTL1MAPT
SCHEMBL24277090 0.82 APP (0.44) APPLTA4HMAPK14BRD4L3MBTL1
SCHEMBL30279504 0.81 PTGER1 (0.46) APPLTA4HMAPK14BRD4MAPT

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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 APP 2554/4885LTA4H 2263/4885MAPK14 4123/4885

“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.