SCHEMBL3784903

SCHEMBL3784903

CCOC(=O)Nc1ccc(B(O)O)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.58
NPC1 O15118 3/20 0.58
HPGD P15428 2/20 0.58
CRHBP P24387 1/20 0.58
CRHR2 Q13324 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.54
ALDH1A1 P00352 3/20 0.52
LMNA P02545 2/20 0.52
HSD17B10 Q99714 2/20 0.52
KDM4E B2RXH2 2/20 0.52
TSHR P16473 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
RECQL P46063 1/20 0.52
CYP2C9 P11712 3/20 0.50
CYP2C19 P33261 3/20 0.50
CYP2D6 P10635 2/20 0.50
CYP1A2 P05177 2/20 0.50
CYP3A4 P08684 1/20 0.50
HTT P42858 1/20 0.50
MTNR1B P49286 1/20 0.50

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
SCHEMBL7565510 0.87 RAB9A (0.71) RAB9ANPC1HPGDCRHBPCRHR2
SCHEMBL918235 0.84 RAB9A (0.65) RAB9ANPC1HPGDSMN1; SMN2ALDH1A1
SCHEMBL3784763 0.83 KDM4E (0.57) RAB9ANPC1HPGDCRHBPCRHR2
SCHEMBL479054 0.82 SMN1; SMN2 (0.62) RAB9ANPC1HPGDSMN1; SMN2LMNA
SCHEMBL9146676 0.82 LMNA (0.68) RAB9ANPC1HPGDCRHBPCRHR2
SCHEMBL1719720 0.82 SMN1; SMN2 (0.71) RAB9ANPC1HPGDCRHBPCRHR2
SCHEMBL7565512 0.82 RAB9A (0.70) RAB9ANPC1HPGDCRHBPCRHR2
SCHEMBL11790359 0.82 RAB9A (0.65) RAB9ANPC1HPGDCRHBPCRHR2
SCHEMBL3786631 0.81 MAPK1 (0.62) RAB9ANPC1HPGDCRHBPCRHR2
SCHEMBL352811 0.80 RAB9A (0.63) RAB9ANPC1HPGDCRHBPCRHR2

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 RAB9A 1357/4885NPC1 724/4885HPGD 2790/4885

“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.