SCHEMBL1769760

SCHEMBL1769760

COC(=O)C1CCc2cc(OC)cnc2N1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 5/20 0.37
MTNR1B P49286 3/20 0.37
NNMT P40261 1/20 0.36
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
ACHE P22303 2/20 0.35
IGF1R P08069 1/20 0.35
HPGDS O60760 2/20 0.34
ABL1 P00519 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
PPARD Q03181 2/20 0.33
KMT2A Q03164 1/20 0.33
GSK3B P49841 1/20 0.32
NQO2 P16083 1/20 0.32

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
SCHEMBL1559871 0.88 HSD17B10 (0.44) MTNR1AMTNR1BNNMTCA1CA2
SCHEMBL7335768 0.76 ALDH1A1 (0.51) MTNR1AMTNR1BCA1CA2ACHE
SCHEMBL30358032 0.76 ALDH1A1 (0.51) MTNR1AMTNR1BCA1CA2ACHE
SCHEMBL13180960 0.74 NNMT (0.40) NNMTALDH1A1HPGDHSD17B10KMT2A
SCHEMBL1769811 0.74 CHRNB2 (0.42) NNMTIGF1RHPGDSALDH1A1TP53
SCHEMBL29153654 0.68 SMN1; SMN2 (0.43) NNMTALDH1A1SMN1; SMN2KMT2A
SCHEMBL5126372 0.68 HSD17B10 (0.46) MTNR1AMTNR1BCA1CA2ACHE
SCHEMBL29153652 0.68 SMN1; SMN2 (0.43) NNMTALDH1A1SMN1; SMN2KMT2A
SCHEMBL30104825 0.68 SMN1; SMN2 (0.43) NNMTALDH1A1SMN1; SMN2KMT2A
SCHEMBL12503258 0.68 IGF1R (0.42) IGF1RALDH1A1KMT2A

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 MTNR1A 2409/4885MTNR1B 3046/4885NNMT 2093/4885

“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.