SCHEMBL715292

SCHEMBL715292

Cc1c(C(=O)NCc2cccc(F)c2)c(=O)n(C)c2cc(C(F)(F)F)ccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 1/20 0.48
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ CCR1 P32246 4/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ HIF1A Q16665 1/20 0.44
▸ MLYCD O95822 1/20 0.44
▸ PDE10A Q9Y233 1/20 0.44
▸ S1PR3 Q99500 1/20 0.44
▸ GLS O94925 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ TACR1 P25103 1/20 0.42
▸ TSHR P16473 1/20 0.41
▸ PLA2G1B P04054 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41

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
SCHEMBL30795780 1.00 ROCK2 (0.48) ROCK2MEN1KMT2ACCR1NPC1
SCHEMBL30795447 0.90 KMT2A (0.54) ROCK2MEN1KMT2ANPC1RAB9A
SCHEMBL28622 0.90 KMT2A (0.54) ROCK2MEN1KMT2ANPC1RAB9A
SCHEMBL30794812 0.90 ROCK2 (0.48) ROCK2MEN1KMT2ACCR1MLYCD
SCHEMBL28973 0.90 ROCK2 (0.48) ROCK2MEN1KMT2ACCR1MLYCD
SCHEMBL30795584 0.89 MEN1 (0.57) MEN1KMT2ACCR1NPC1RAB9A
SCHEMBL714808 0.89 MEN1 (0.57) MEN1KMT2ACCR1NPC1RAB9A
SCHEMBL29002 0.89 S1PR3 (0.45) ROCK2CCR1MLYCDPDE10AS1PR3
SCHEMBL30795738 0.89 S1PR3 (0.47) ROCK2MEN1KMT2ACCR1MLYCD
SCHEMBL30795875 0.89 S1PR3 (0.45) ROCK2CCR1MLYCDPDE10AS1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2609086-B1 SUBSTITUTED 2-OXO- AND 2-THIOXO-DIHYDROQUINOLINE-3-CARBOXAMIDES AS KCNQ2/3 MODULATORS GRUENENTHAL GMBH (DE) 2015-02-25 — — EP claimed
US-8653102-B2 Substituted 2-oxo- and 2-thioxo-dihydroquinoline-3-carboxamides as KCNQ2/3 modulators GRUENENTHAL GMBH (DE) 2014-02-18 — — US claimed
US-20120053206-A1 Substituted 2-oxo- and 2-thioxo-dihydroquinoline-3-carboxamides as KCNQ2/3 modulators GRUNENTHAL GMBH (DE) 2012-03-01 — — US claimed
WO-2024054807-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND TDP-43 MODULATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 — — WO disclosed
WO-2024050389-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND NMDA RECEPTOR ANTAGONISTS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-07 — — WO disclosed
EP-2609086-B1 SUBSTITUTED 2-OXO- AND 2-THIOXO-DIHYDROQUINOLINE-3-CARBOXAMIDES AS KCNQ2/3 MODULATORS GRUENENTHAL GMBH (DE) 2015-02-25 — — EP disclosed
US-8653102-B2 Substituted 2-oxo- and 2-thioxo-dihydroquinoline-3-carboxamides as KCNQ2/3 modulators GRUENENTHAL GMBH (DE) 2014-02-18 — — US disclosed
US-20120053206-A1 Substituted 2-oxo- and 2-thioxo-dihydroquinoline-3-carboxamides as KCNQ2/3 modulators GRUNENTHAL GMBH (DE) 2012-03-01 — — 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-20120053206-A1 Substituted 2-oxo- and 2-thioxo-dihydroquinoline-3-carboxamides as KCNQ2/3 modulators KCNQ1, KCNQ2, KCNQ3 ROCK2 4161/4885MEN1 4185/4885KMT2A 217/4885

“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.

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