SCHEMBL9928283

SCHEMBL9928283

CC1CCN(Cc2c[nH]c3ncnc(Cl)c23)CC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
DRD3 P35462 1/20 0.46
ALDH1A1 P00352 2/20 0.43
CHEK1 O14757 1/20 0.42
LRRK2 Q5S007 3/20 0.41
ACHE P22303 3/20 0.40
HRH3 Q9Y5N1 1/20 0.39
ALOX15 P16050 1/20 0.39
AKT1 P31749 2/20 0.38
LCK P06239 1/20 0.38
MET P08581 3/20 0.37
MERTK Q12866 3/20 0.37
AXL P30530 2/20 0.37
RAB9A P51151 2/20 0.37
MITF O75030 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL9928286 0.88 CHEK1 (0.40) DRD2DRD4DRD3CHEK1LRRK2
SCHEMBL9928287 0.86 CHEK1 (0.40) CHEK1LRRK2ALOX15AKT1LCK
SCHEMBL30974955 0.85 ALOX15 (0.51) DRD2DRD4DRD3CHEK1LRRK2
SCHEMBL9928284 0.82 CHEK1 (0.42) DRD2DRD4DRD3CHEK1LRRK2
SCHEMBL9928293 0.79 ERBB2 (0.44) DRD2DRD4DRD3LCK
SCHEMBL9943127 0.78 BTK (0.50) DRD2LRRK2AKT1
SCHEMBL9928282 0.78 EGFR (0.53) LRRK2
SCHEMBL9898012 0.77 CHEK1 (0.40) DRD2DRD4DRD3ALDH1A1CHEK1
SCHEMBL9928285 0.76 CHEK1 (0.37) DRD2DRD4DRD3CHEK1LRRK2
SCHEMBL9928280 0.76 EGFR (0.54) LCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120149902-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVE UBE INDUSTRIES, LTD. (JP) 2012-06-14 US 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-20120149902-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVE ERBB2, EGFR, FGFR1 DRD2 870/4885DRD4 644/4885DRD3 954/4885

“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.