SCHEMBL13616247

SCHEMBL13616247

CCC(CC)N1CCc2cnc(Cl)nc21

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
ABL1 P00519 1/20 0.34
BCR P11274 1/20 0.34
CRHR1 P34998 6/20 0.34
MAPT P10636 1/20 0.33

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
SCHEMBL1203578 0.76 SMN1; SMN2 (0.35) SMN1; SMN2ABL1BCRCRHR1
SCHEMBL1203941 0.76 TTK (0.35) SMN1; SMN2ABL1BCRCRHR1
SCHEMBL13616148 0.75 MAPK1 (0.45)
SCHEMBL4189963 0.73 USP1 (0.39) SMN1; SMN2ABL1BCR
SCHEMBL12381902 0.70 MTNR1A (0.44)
SCHEMBL20251041 0.69 PIK3R1 (0.33)
SCHEMBL12384206 0.67 CRHR1 (0.41) CRHR1
SCHEMBL13616133 0.66 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL3538717 0.66 SMN1; SMN2 (0.34) SMN1; SMN2ABL1BCR
SCHEMBL27810553 0.65 GAA (0.47) SMN1; SMN2MAPT

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-8324225-B2 Pyrrolopyrimidine compounds and their uses NOVARTIS AG (CH) 2012-12-04 US disclosed
US-20090318441-A1 Pyrrolopyrimidine Compounds and Their Uses ASTEX THERAPEUTICS LTD. 2009-12-24 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-20090318441-A1 Pyrrolopyrimidine Compounds and Their Uses PRKDC, TK2, PNKP SMN1; SMN2 2559/4885ABL1 292/4885BCR 1482/4885

“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.