SCHEMBL22829307

SCHEMBL22829307

Cc1cc2cc(-c3ccccc3C(F)(F)F)n(C(=O)OC(C)(C)C)c2nc1Cl

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 6/20 0.38
HSD11B1 P28845 5/20 0.36
PTGES O14684 3/20 0.36
TTK P33981 1/20 0.35
BRD4 O60885 1/20 0.35
CREBBP Q92793 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
SCN9A Q15858 1/20 0.35
EED O75530 1/20 0.34
HTT P42858 1/20 0.34
NR1H3 Q13133 1/20 0.34

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
SCHEMBL29891011 1.00 NR1H2 (0.38) NR1H2HSD11B1PTGESTTKBRD4
SCHEMBL20455581 0.86 HSD11B1 (0.40) HSD11B1SCN9AHTT
SCHEMBL21657878 0.85 NR1H2 (0.39) NR1H2HSD11B1TTKBRD4CREBBP
SCHEMBL29891744 0.85 NR1H2 (0.39) NR1H2HSD11B1TTKBRD4CREBBP
SCHEMBL29891226 0.80 NR1H2 (0.41) NR1H2BRD4CREBBPSCN9AEED
SCHEMBL21629658 0.78 NR1H2 (0.43) NR1H2BRD4CREBBPNR1H3
SCHEMBL21657932 0.78 TTK (0.47) NR1H2TTKBRD4CREBBPNR1H3
SCHEMBL32673777 0.76 HSP90AA1 (0.34) NR1H2TTKPOLBNR1H3
SCHEMBL22838260 0.76 HSP90AA1 (0.34) NR1H2HSD11B1TTKBRD4POLB
SCHEMBL20455606 0.75 NR1H2 (0.39) NR1H2TTKBRD4CREBBPEED

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
CN-110248940-B Aryl hydrocarbon receptor (AhR) modulator compounds 菲尼克斯药品股份公司 2022-07-01 CN disclosed
US-10981908-B2 Aryl hydrocarbon receptor (AHR) modulator compounds PHENEX PHARMACEUTICALS AG (DE) 2021-04-20 US disclosed
US-10981908-B2 Aryl hydrocarbon receptor (AHR) modulator compounds PHENEX PHARMACEUTICALS AG (DE) 2021-04-20 US disclosed
EP-3577112-B1 ARYL HYDROCARBON RECEPTOR (AHR) MODULATOR COMPOUNDS PHENEX PHARMACEUTICALS AG (DE) 2020-12-30 EP disclosed
EP-3577112-B1 ARYL HYDROCARBON RECEPTOR (AHR) MODULATOR COMPOUNDS PHENEX PHARMACEUTICALS AG (DE) 2020-12-30 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 (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-10981908-B2 Aryl hydrocarbon receptor (AHR) modulator compounds AHR, ARNT, NR1H2 NR1H2 3/4885HSD11B1 244/4885PTGES 820/4885

“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.