SCHEMBL961710

SCHEMBL961710

Cc1nn(Cc2ccccc2)c(-n2ccc3cccnc32)c1C=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
KMT2A Q03164 4/20 0.39
HPGD P15428 3/20 0.39
MEN1 O00255 3/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 3/20 0.39
NPSR1 Q6W5P4 2/20 0.39
LMNA P02545 2/20 0.39
KDM4E B2RXH2 4/20 0.38
TDP1 Q9NUW8 1/20 0.38
HTT P42858 2/20 0.38
CYP2C19 P33261 2/20 0.38
POLB P06746 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
ATM Q13315 1/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
P2RX7 Q99572 1/20 0.35

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
SCHEMBL963546 0.87 L3MBTL1 (0.46) L3MBTL1KMT2AHPGDMEN1MAPT
SCHEMBL963544 0.87 L3MBTL1 (0.46) L3MBTL1KMT2AHPGDMEN1MAPT
SCHEMBL962643 0.84 L3MBTL1 (0.46) L3MBTL1KMT2AHPGDMEN1MAPT
SCHEMBL962642 0.84 L3MBTL1 (0.46) L3MBTL1KMT2AHPGDMEN1MAPT
SCHEMBL962641 0.83 POLB (0.45) L3MBTL1KMT2AHPGDMEN1ALDH1A1
SCHEMBL962123 0.80 L3MBTL1 (0.40) L3MBTL1MAPTLMNAHTTCYP2C19
SCHEMBL27772577 0.78 L3MBTL1 (0.43) L3MBTL1KMT2AHPGDMEN1ALDH1A1
SCHEMBL964548 0.77 PPARG (0.40) L3MBTL1KMT2AHPGDMEN1ALDH1A1
SCHEMBL964545 0.77 PPARG (0.40) L3MBTL1KMT2AHPGDMEN1ALDH1A1
SCHEMBL3322315 0.71 HPGD (0.63) L3MBTL1KMT2AHPGDMEN1MAPT

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
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-13 US disclosed
EP-2118066-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA Takeda Pharmaceutical Company Limited (JP) 2009-11-18 EP disclosed
WO-2008099794-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-08-21 WO disclosed
US-20080194617-A1 Fused ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-08-14 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 (2 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-20080194617-A1 Fused ring compound SLC5A1, SLC5A2, GPR119 L3MBTL1 2943/4885KMT2A 1809/4885HPGD 598/4885
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA PPARA, PPARD, PPARG L3MBTL1 3858/4885KMT2A 2017/4885HPGD 378/4885

“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.