SCHEMBL2177475

SCHEMBL2177475

COc1ccc(Cn2nc(N(C)C(=O)OC(C)(C)C)cc2N)cc1OC

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MTNR1A P48039 1/20 0.42
MTNR1B P49286 1/20 0.42
CACNA1H O95180 3/20 0.40
HTR2C P28335 1/20 0.37
SLC6A4 P31645 1/20 0.37
CYP19A1 P11511 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAPK10 P53779 1/20 0.36
RAD52 P43351 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL2173221 0.84 LMNA (0.40) LMNASMN1; SMN2MTNR1AMTNR1BCACNA1H
SCHEMBL2172802 0.78 LMNA (0.44) LMNASMN1; SMN2CACNA1HCYP19A1ATM
SCHEMBL2172795 0.78 CACNA1H (0.47) LMNASMN1; SMN2MTNR1AMTNR1BCACNA1H
SCHEMBL16629273 0.67 BRD4 (0.35) HTR2CSLC6A4
SCHEMBL15784061 0.66 TTK (0.41) LMNAMTNR1AMTNR1BL3MBTL1
SCHEMBL29632640 0.66 TTK (0.41) LMNAMTNR1AMTNR1BL3MBTL1
SCHEMBL30298020 0.66 CACNA1H (0.48) SMN1; SMN2CACNA1HCYP19A1L3MBTL1MEN1
SCHEMBL24035218 0.66 HTR2C (0.40) SMN1; SMN2CACNA1HHTR2CSLC6A4L3MBTL1
SCHEMBL3915767 0.66 ALDH1A1 (0.42) LMNAMTNR1AMTNR1BCYP19A1L3MBTL1
SCHEMBL15156318 0.66 ALDH1A1 (0.46) LMNAMTNR1AMTNR1BL3MBTL1MEN1

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-7973164-B2 Quinoline derivatives ASTRAZENECA AB (SE) 2011-07-05 US disclosed
US-20090076074-A1 QUINOLINE DERIVATIVES ASTRAZENECA AB (SE) 2009-03-19 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-20090076074-A1 QUINOLINE DERIVATIVES RECQL, NQO2, CCNA1 LMNA 1122/4885SMN1; SMN2 2298/4885MTNR1A 291/4885

“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.