SCHEMBL3315976

SCHEMBL3315976

CC(=O)N1CCN(c2ccc(N)c(C)c2C)CC1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.60
CASP6 P55212 1/20 0.53
GFER P55789 1/20 0.53
NCF1 P14598 2/20 0.47
LMNA P02545 2/20 0.46
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 2/20 0.42
NPSR1 Q6W5P4 1/20 0.41
GBA1 P04062 1/20 0.40
KDM4E B2RXH2 2/20 0.40
MAP4K4 O95819 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CLK1 P49759 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL3312656 0.86 ALDH1A1 (0.72) ALDH1A1CASP6GFERNCF1LMNA
SCHEMBL15358684 0.84 MAPT (0.44) ALDH1A1GFERLMNAMEN1KMT2A
SCHEMBL3311256 0.84 ALDH1A1 (0.54) ALDH1A1CASP6GFERNCF1LMNA
SCHEMBL11414381 0.81 MAPT (0.52) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL24196352 0.80 ALDH1A1 (0.56) ALDH1A1CASP6GFERNCF1LMNA
SCHEMBL3316445 0.77 ALDH1A1 (0.49) ALDH1A1CASP6GFERNCF1LMNA
SCHEMBL12890006 0.77 ADRA2C (0.61) ALDH1A1CASP6GFERNCF1MEN1
SCHEMBL188894 0.76 MAPT (0.61) ALDH1A1CASP6GFERNCF1LMNA
SCHEMBL21084414 0.75 ALDH1A1 (1.00) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL29462025 0.75 ALDH1A1 (1.00) ALDH1A1LMNAMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010049731-A1 PYRAZOLO- AND IMIDAZOPYRIDINYLPYRIMIDINEAMINES AS IGF-1R TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2010-05-06 WO disclosed
US-20100105655-A1 NOVEL COMPOUNDS 515 ASTRAZENECA AB 2010-04-29 US disclosed
US-20100105655-A1 NOVEL COMPOUNDS 515 ASTRAZENECA AB 2010-04-29 US disclosed
US-20100105655-A1 NOVEL COMPOUNDS 515 ASTRAZENECA AB 2010-04-29 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-20100105655-A1 NOVEL COMPOUNDS 515 TYMS, ABCG2, UMPS ALDH1A1 649/4885CASP6 2309/4885GFER 4798/4885

“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.