SCHEMBL2471769

SCHEMBL2471769

Cc1ccc(C2c3c(C)c(N4C(=O)CC(c5ccc(F)cc5)CC4=O)c(C)c(C)c3OC2(C)C)cc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.35
GAA P10253 2/20 0.35
TDP1 Q9NUW8 1/20 0.34
NPC1 O15118 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.31
MAPK1 P28482 1/20 0.31
HTR7 P34969 1/20 0.31
MAP1LC3B Q9GZQ8 1/20 0.31
RAB9A P51151 1/20 0.31
MAOB P27338 4/20 0.31
ALPL P05186 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL2476027 0.95 NPC1 (0.35) NPC1MAPTMAP1LC3B
SCHEMBL2476025 0.95 NPC1 (0.35) NPC1MAPTMAP1LC3B
SCHEMBL2477382 0.91 BRD4 (0.34) GAATDP1NPC1MEN1KMT2A
SCHEMBL2477385 0.91 BRD4 (0.34) GAATDP1NPC1MEN1KMT2A
SCHEMBL2471705 0.88 MEN1 (0.39) L3MBTL1GAANPC1MEN1KMT2A
SCHEMBL2471707 0.88 MEN1 (0.39) L3MBTL1GAANPC1MEN1KMT2A
SCHEMBL2470548 0.84 NPC1 (0.44) NPC1POLB
SCHEMBL2470551 0.84 NPC1 (0.44) NPC1POLB
SCHEMBL2468274 0.81 NPC1 (0.36) NPC1ALDH1A1MAPTMAPK1RAB9A
SCHEMBL4037626 0.81 PGR (0.39) MEN1KMT2AHTR7ALPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1411052-B1 BENZO-FUSED 5-MEMBERED HETROCYCLE COMPOUNDS,PROCESS FOR PREPARATION OF THE SAME, AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2011-10-05 EP disclosed
US-20070149558-A1 Benzo-fused 5-membered heterocyclic compounds, their production and use OHKAWA SHIGENORI 2007-06-28 US disclosed
US-7208495-B2 Benzo-fused 5-membered hetrocycle compounds, process for preparation of the same, and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-04-24 US disclosed
US-20040167171-A1 Benzo-fused 5-membered hetrocycle compounds, process for preparation of the same, and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-08-26 US disclosed
EP-1411052-A1 BENZO-FUSED 5-MEMBERED HETROCYCLE COMPOUNDS,PROCESS FOR PREPARATION OF THE SAME, AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2004-04-21 EP 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-20070149558-A1 Benzo-fused 5-membered heterocyclic compounds, their production and use CBR1, DBH, PARK7 L3MBTL1 646/4885GAA 1444/4885TDP1 1754/4885
US-20040167171-A1 Benzo-fused 5-membered hetrocycle compounds, process for preparation of the same, and use thereof CYP8B1, PARK7, OXER1 L3MBTL1 2384/4885GAA 1960/4885TDP1 2951/4885

“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.