SCHEMBL18513614

SCHEMBL18513614

O=C1CCc2cc(Cl)c(Br)cc2N1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PKM P14618 13/20 0.47
CA9 Q16790 1/20 0.46
NPC1 O15118 1/20 0.43
MAPK13 O15264 1/20 0.43
MAPK12 P53778 1/20 0.43
MAPK11 Q15759 1/20 0.43
MAPK14 Q16539 1/20 0.43
PKLR P30613 1/20 0.41
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
CMA1 P23946 2/20 0.40
AHR P35869 2/20 0.40
KIF11 P52732 2/20 0.40

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
SCHEMBL14778943 0.93 PKM (0.50) PKMCA9NPC1MAPK13MAPK12
SCHEMBL19278654 0.85 CA9 (0.52) PKMCA9NPC1MAPK13MAPK12
SCHEMBL12559817 0.79 PKM (0.56) PKMCA9NPC1MAPK13MAPK12
SCHEMBL19260285 0.79 PKM (0.56) PKMCA9NPC1MAPK13MAPK12
SCHEMBL12992058 0.79 CA9 (0.54) PKMCA9NPC1MAPK13MAPK12
SCHEMBL18112918 0.79 CA9 (0.46) PKMCA9NPC1MAPK13MAPK12
SCHEMBL10570246 0.79 CYP19A1 (0.51) PKMCA9NPC1MAPK13MAPK12
SCHEMBL4609019 0.78 KIF11 (0.57) PKMNPC1MAPK13MAPK12MAPK11
SCHEMBL16050307 0.76 AHR (0.53) MAOBCMA1AHR
SCHEMBL7377454 0.75 CA9 (0.54) PKMCA9NPC1MAPK13MAPK12

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-20200299262-A1 ARYL-SUBSTITUTED DIHYDROQUINOLINONES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS EPIGENETIX, INC. 2020-09-24 US disclosed
EP-3334717-B1 ARYL-SUBSTITUTED DIHYDROQUINOLINONES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS NEOMED INST (CA) 2020-07-01 EP disclosed
EP-3334717-B1 ARYL-SUBSTITUTED DIHYDROQUINOLINONES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS NEOMED INST (CA) 2020-07-01 EP disclosed
WO-2017024408-A1 ARYL-SUBSTITUTED DIHYDROQUINOLINONES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS NEOMED INSTITUTE (CA) 2017-02-16 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-20200299262-A1 ARYL-SUBSTITUTED DIHYDROQUINOLINONES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS BRPF3, BRD4, BRDT PKM 2752/4885CA9 4195/4885NPC1 2979/4885

“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.