SCHEMBL4482995

SCHEMBL4482995

CCC(CC)c1cc(C)c2nc(-c3cc4c(cc3C)OCO4)c(C(N)=O)n2c1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.42
MAPT P10636 3/20 0.31
ALDH1A1 P00352 3/20 0.31
GAA P10253 2/20 0.31
EDNRA P25101 1/20 0.31
TGFBR1 P36897 1/20 0.31
THRB P10828 1/20 0.31
KDM4E B2RXH2 2/20 0.30
NPC1 O15118 1/20 0.30
TP53 P04637 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
LMNA P02545 1/20 0.30
HTT P42858 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL4492009 0.87 CRHR1 (0.36) CRHR1
SCHEMBL4479812 0.82 CRHR1 (0.39) CRHR1MAPTALDH1A1KDM4E
SCHEMBL4498283 0.78 CRHR1 (0.54) CRHR1
SCHEMBL4494321 0.78 CRHR1 (0.44) CRHR1MAPTALDH1A1KDM4EHPGD
SCHEMBL4480818 0.78 CRHR1 (0.43) CRHR1
SCHEMBL4500640 0.76 CRHR1 (0.47) CRHR1MAPTALDH1A1GAAKDM4E
SCHEMBL4487108 0.75 CRHR1 (0.34) CRHR1
SCHEMBL4483814 0.74 CRHR1 (0.45) CRHR1
SCHEMBL4499176 0.65 CRHR1 (0.46) CRHR1
SCHEMBL4486617 0.64 CDC7 (0.47) CRHR1ALDH1A1KDM4EHPGDSMN1; SMN2

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 CRHR1 1/4885MAPT 3884/4885ALDH1A1 3438/4885

“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.