SCHEMBL3789240

SCHEMBL3789240

Nc1cccc(Oc2ccccc2)c1-c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCOA1 Q15788 1/20 0.49
NCOA3 Q9Y6Q9 1/20 0.49
BRD4 O60885 2/20 0.48
GAA P10253 3/20 0.47
ALDH1A1 P00352 2/20 0.47
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
IKBKB O14920 1/20 0.44
BRAF P15056 1/20 0.44
DPP4 P27487 1/20 0.43
MAOB P27338 1/20 0.42
MAOA P21397 1/20 0.42
HRH1 P35367 1/20 0.42
RCE1 Q9Y256 1/20 0.42
CTNNB1 P35222 1/20 0.42
LTA4H P09960 1/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL25135315 0.91 NCOA1 (0.62) NCOA1NCOA3BRD4GAAALDH1A1
SCHEMBL3800513 0.91 NCOA1 (0.53) NCOA1NCOA3BRD4GAAALDH1A1
SCHEMBL4965452 0.90 ALDH1A1 (0.43) NCOA1NCOA3BRD4GAAALDH1A1
SCHEMBL25135310 0.88 MAOB (0.58) NCOA1NCOA3BRD4GAAALDH1A1
SCHEMBL3789550 0.88 MAOB (0.53) NCOA1NCOA3BRD4GAAALDH1A1
SCHEMBL25135312 0.86 KDM4E (0.47) NCOA1NCOA3BRD4GAAALDH1A1
SCHEMBL3790679 0.83 NCOA1 (0.47) NCOA1NCOA3BRD4GAAALDH1A1
SCHEMBL11749957 0.81 ALDH1A1 (0.45) NCOA1NCOA3BRD4GAAALDH1A1
SCHEMBL27603607 0.81 TSHR (0.41) NCOA1NCOA3BRD4GAAALDH1A1
SCHEMBL10907085 0.81 NCOA1 (0.68) NCOA1NCOA3GAAALDH1A1CYP3A4

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 NCOA1 2120/4885NCOA3 989/4885BRD4 96/4885

“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.