SCHEMBL10277983

SCHEMBL10277983

Cc1cc(F)ccc1N1CCC(C=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
ALDH1A3 P47895 2/20 0.45
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
GAA P10253 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 2/20 0.43
HTR7 P34969 1/20 0.40
ADAMTS5 Q9UNA0 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 4/20 0.39
THRB P10828 2/20 0.39
TP53 P04637 1/20 0.39
AVPR1A P37288 1/20 0.38
HCAR1 Q9BXC0 1/20 0.37
MEN1 O00255 1/20 0.37
NR4A1 P22736 1/20 0.37
KMT2A Q03164 1/20 0.37
PTK2B Q14289 1/20 0.37
HTT P42858 4/20 0.36

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
SCHEMBL6668947 0.84 SMN1; SMN2 (0.47) ALDH1A1GAASMN1; SMN2MAPTHTT
Hydrochloric Acid SCHEMBL1836445 0.83 ALDH1A1 (0.46) ALDH1A1GAASMN1; SMN2HTTDPP4
Hydrochloric Acid SCHEMBL2366847 0.83 ALDH1A1 (0.48) ALDH1A1ALDH1A3DRD2DRD4GAA
SCHEMBL3436537 0.82 ALDH1A1 (0.43) ALDH1A1ALDH1A3DRD2DRD4GAA
SCHEMBL3551275 0.79 MAPT (0.37) ALDH1A1GAASMN1; SMN2LMNAL3MBTL1
SCHEMBL3559786 0.79 HTR3E (0.58) ALDH1A1ALDH1A3SMN1; SMN2HTR7L3MBTL1
SCHEMBL26511741 0.79 SMN1; SMN2 (0.45) ALDH1A1GAASMN1; SMN2LMNAMAPT
SCHEMBL3436604 0.78 NOTUM (0.52) DRD2DRD4GAASMN1; SMN2LMNA
SCHEMBL4603708 0.74 ALDH1A1 (0.48) ALDH1A1ALDH1A3DRD2DRD4GAA
SCHEMBL1814706 0.74 NOTUM (0.50) ALDH1A1GAASMN1; SMN2LMNAMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163746-B2 Azolecarboxamide derivative ASTELLAS PHARMA INC. (JP) 2012-04-24 US disclosed
US-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-11-19 US disclosed
EP-2009005-A1 AZOLECARBOXAMIDE DERIVATIVE Astellas Pharma Inc. (JP) 2008-12-31 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-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE GPR17, NTRK1, TRPV1 ALDH1A1 975/4885ALDH1A3 738/4885DRD2 3571/4885

“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.