SCHEMBL1769807

SCHEMBL1769807

COC(=O)C1CCc2nc(OC)ccc2N1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
IGF1R P08069 1/20 0.39
DRD2 P14416 2/20 0.39
DRD3 P35462 1/20 0.39
MTNR1A P48039 5/20 0.36
MTNR1B P49286 5/20 0.36
HTR2C P28335 4/20 0.36
DRD1 P21728 1/20 0.35
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
KMT2A Q03164 1/20 0.34
NNMT P40261 1/20 0.33
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
SCHEMBL1559298 0.88 ALDH1A1 (0.51) ALDH1A1TP53CYP1A2HPGDSMN1; SMN2
SCHEMBL2608535 0.76 GAA (0.43) ALDH1A1TP53CYP1A2HPGDSMN1; SMN2
SCHEMBL1769811 0.72 CHRNB2 (0.42) ALDH1A1TP53CYP1A2HPGDSMN1; SMN2
SCHEMBL30358032 0.71 ALDH1A1 (0.51) ALDH1A1TP53CYP1A2HPGDSMN1; SMN2
SCHEMBL7335768 0.71 ALDH1A1 (0.51) ALDH1A1TP53CYP1A2HPGDSMN1; SMN2
SCHEMBL17656944 0.70 DRD2 (0.40) DRD2DRD3MTNR1AMTNR1BHTR2C
SCHEMBL7433964 0.70 SMYD3 (0.56) ALDH1A1CYP1A2HPGDHSD17B10IGF1R
SCHEMBL8567081 0.70 SMYD3 (0.56) ALDH1A1CYP1A2HPGDHSD17B10IGF1R
SCHEMBL926907 0.70 SMYD3 (0.56) ALDH1A1CYP1A2HPGDHSD17B10IGF1R
SCHEMBL30357995 0.70 SMYD3 (0.56) ALDH1A1CYP1A2HPGDHSD17B10IGF1R

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-20110112104-A1 TRICYCLIC COMPOUNDS, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM. LES LABORATOIRES SERVIER (FR) 2011-05-12 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-20110112104-A1 TRICYCLIC COMPOUNDS, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM. BAX, CASP3, BCL2 ALDH1A1 2604/4885TP53 136/4885CYP1A2 34/4885

“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.