SCHEMBL4478897

SCHEMBL4478897

CCOC(=O)C(Br)C(=O)c1ccc(OC)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.43
TYK2 P29597 1/20 0.43
RAB9A P51151 4/20 0.42
MAPT P10636 2/20 0.42
FLT1 P17948 1/20 0.41
FLT4 P35916 1/20 0.41
KDR P35968 1/20 0.41
ALDH1A1 P00352 6/20 0.40
HPGD P15428 5/20 0.40
KDM4E B2RXH2 4/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MAPK1 P28482 2/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CLPP Q16740 2/20 0.40
MAOB P27338 2/20 0.39
CA12 O43570 1/20 0.39
CA2 P00918 1/20 0.39
GLA P06280 1/20 0.39
CA3 P07451 1/20 0.39

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
SCHEMBL4488614 0.86 HTT (0.50) RAB9AMAPTALDH1A1HPGDKDM4E
SCHEMBL954293 0.85 TDP1 (0.47) MAPTALDH1A1HPGDKDM4EL3MBTL1
SCHEMBL1922880 0.80 JAK2 (0.49) JAK2TYK2RAB9AMAPTFLT1
SCHEMBL14740031 0.79 TSHR (0.47) ALDH1A1HPGDTSHRNPC1LMNA
SCHEMBL3129736 0.77 ALDH1A1 (0.55) RAB9AMAPTALDH1A1MAPK1TDP1
SCHEMBL17282273 0.76 ALDH1A1 (0.42) RAB9AMAPTALDH1A1HPGDKDM4E
SCHEMBL14752128 0.76 CYP4F2 (0.47) MAPTALDH1A1HPGDKDM4ETSHR
SCHEMBL29488735 0.76 LMNA (0.53) MAPTALDH1A1HPGDKDM4ETSHR
SCHEMBL29488737 0.76 LMNA (0.53) MAPTALDH1A1HPGDKDM4ETSHR
SCHEMBL930838 0.76 LMNA (0.53) MAPTALDH1A1HPGDKDM4ETSHR

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-20090281120-A1 BICYCLIC HETEROCYCLIC COMPOUND ONO PHARMACEUTICAL CO., LTD (JP) 2009-11-12 US disclosed
EP-1961745-A1 BICYCLIC HETEROCYCLIC COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2008-08-27 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-20090281120-A1 BICYCLIC HETEROCYCLIC COMPOUND CRHR1, NR3C1, CNR1 JAK2 1541/4885TYK2 2237/4885RAB9A 1616/4885

“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.