SCHEMBL17397156

SCHEMBL17397156

CC(=O)c1cc(=O)n2c(C)cccc2c1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
MAPT P10636 6/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 4/20 0.35
NPC1 O15118 2/20 0.35
TP53 P04637 2/20 0.35
RAB9A P51151 2/20 0.35
CA5A P35218 1/20 0.34
KMT2A Q03164 1/20 0.34
TSHR P16473 1/20 0.34
CYP19A1 P11511 1/20 0.34
MAOB P27338 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 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
SCHEMBL17397158 0.71 MAPT (0.42) KDM4EMAPTSMN1; SMN2ALDH1A1NPC1
SCHEMBL17397181 0.70 KDM4E (0.39) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL17397188 0.67 PIK3CD (0.41) KDM4EMAPTSMN1; SMN2ALDH1A1NPC1
SCHEMBL4467335 0.67 L3MBTL1 (0.38) KDM4EMAPTSMN1; SMN2ALDH1A1RAB9A
SCHEMBL3892014 0.63 KDM4E (0.39) KDM4EMAPTSMN1; SMN2ALDH1A1RAB9A
SCHEMBL27404239 0.62 ACHE (0.33) KDM4EMAPTSMN1; SMN2ALDH1A1TP53
SCHEMBL8578864 0.62 CHRNA7 (0.51) KDM4EMAPTSMN1; SMN2ALDH1A1TP53
SCHEMBL279656 0.62 ALDH1A1 (0.59) SMN1; SMN2ALDH1A1NPC1RAB9AKMT2A
Benzene SCHEMBL5533098 0.61 MAPT (0.75) MAPTSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL50646 0.61 MAPT (0.68) KDM4EMAPTSMN1; SMN2ALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9944639-B2 Quinolizinone derivatives as PI3K inhibitors LUPIN LIMITED (IN) 2018-04-17 US disclosed
US-9944639-B2 Quinolizinone derivatives as PI3K inhibitors LUPIN LIMITED (IN) 2018-04-17 US disclosed
US-9944639-B2 Quinolizinone derivatives as PI3K inhibitors LUPIN LIMITED (IN) 2018-04-17 US disclosed
US-20170137421-A1 QUINOLIZINONE DERIVATIVES AS PI3K INHIBITORS LUPIN LIMITED (IN) 2017-05-18 US disclosed
US-20170137421-A1 QUINOLIZINONE DERIVATIVES AS PI3K INHIBITORS LUPIN LIMITED (IN) 2017-05-18 US disclosed
US-20170137421-A1 QUINOLIZINONE DERIVATIVES AS PI3K INHIBITORS LUPIN LIMITED (IN) 2017-05-18 US disclosed
EP-3164400-A1 QUINOLIZINONE DERIVATIVES AS PI3K INHIBITORS Lupin Limited (IN) 2017-05-10 EP disclosed
WO-2016001855-A1 QUINOLIZINONE DERIVATIVES AS PI3K INHIBITORS LUPIN LIMITED (IN) 2016-01-07 WO disclosed
WO-2016001855-A1 QUINOLIZINONE DERIVATIVES AS PI3K INHIBITORS LUPIN LIMITED (IN) 2016-01-07 WO 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-20170137421-A1 QUINOLIZINONE DERIVATIVES AS PI3K INHIBITORS PIK3R5, PIK3R1, PIK3R4 KDM4E 904/4885MAPT 1030/4885SMN1; SMN2 2919/4885

“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.