SCHEMBL7085378

SCHEMBL7085378

Clc1ccc(-c2ccc3cc[nH]c3c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 4/20 0.70
CMA1 P23946 1/20 0.70
F7 P08709 1/20 0.53
LTA4H P09960 1/20 0.53
F3 P13726 1/20 0.53
NR4A2 P43354 1/20 0.53
ESR1 P03372 1/20 0.50
NPC1 O15118 1/20 0.48
TYR P14679 1/20 0.48
CHRNB4 P30926 1/20 0.47
CHRNA3 P32297 1/20 0.47
CHRNA7 P36544 1/20 0.47
CHRNA10 Q9GZZ6 1/20 0.47
CHRNA9 Q9UGM1 1/20 0.47
BRD4 O60885 1/20 0.45
PIP4K2A P48426 1/20 0.44
PIP4K2B P78356 1/20 0.44
ENPP2 Q13822 2/20 0.44
CSNK2A1 P68400 1/20 0.44
MEN1 O00255 1/20 0.44

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
SCHEMBL4486564 0.84 AHR (0.70) AHRCMA1F7LTA4HF3
SCHEMBL5664020 0.83 AHR (0.63) AHRCMA1F7LTA4HF3
SCHEMBL29990254 0.83 AHR (1.00) AHRCMA1F7LTA4HF3
SCHEMBL75475 0.83 AHR (1.00) AHRCMA1F7LTA4HF3
SCHEMBL443799 0.82 NPC1 (0.71) AHRCMA1NPC1TYRCHRNB4
SCHEMBL30253604 0.82 NPC1 (0.71) AHRCMA1NPC1TYRCHRNB4
Methane SCHEMBL27929624 0.81 AHR (0.95) AHRCMA1F7LTA4HF3
SCHEMBL27701627 0.81 AHR (0.95) AHRCMA1F7LTA4HF3
Biphenyl SCHEMBL27962709 0.81 AHR (0.78) AHRCMA1F7LTA4HF3
SCHEMBL13115618 0.80 BRD4 (0.53) AHRCMA1ESR1NPC1TYR

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
CN-109503598-A The method of level-one amine guiding building 6- (4- chlorphenyl) indoles simultaneously [1,2-a] quinoxaline 桂林理工大学 2019-03-22 CN disclosed
CN-109503598-A The method of level-one amine guiding building 6- (4- chlorphenyl) indoles simultaneously [1,2-a] quinoxaline 桂林理工大学 2019-03-22 CN disclosed
CN-109503598-A The method of level-one amine guiding building 6- (4- chlorphenyl) indoles simultaneously [1,2-a] quinoxaline 桂林理工大学 2019-03-22 CN disclosed
US-20030203959-A1 Novel modulators of potassium channels 4SC AG (DE) 2003-10-30 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-20030203959-A1 Novel modulators of potassium channels HCN3, KCNN3, KCNN1 AHR 379/4885CMA1 1511/4885F7 4615/4885

“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.