SCHEMBL29587732

SCHEMBL29587732

N#Cc1cc(-c2cccc(F)c2)c(O)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FASN P49327 5/20 0.45
CYP11B2 P19099 2/20 0.43
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
ESR2 Q92731 1/20 0.41
GRM5 P41594 1/20 0.40
MAP4K4 O95819 1/20 0.39
GPR35 Q9HC97 1/20 0.38
AR P10275 2/20 0.38
PGR P06401 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL18617426 1.00 FASN (0.45) FASNCYP11B2KDM4EHPGDNPSR1
SCHEMBL18617407 0.83 CNR1 (0.47) FASNCYP11B2KDM4EHPGDCNR1
SCHEMBL18587347 0.82 MAOA (0.53) FASNKDM4EHPGDNPSR1CNR1
SCHEMBL28838740 0.82 KDM4E (0.48) KDM4EHPGDNPSR1RXFP1ESR2
SCHEMBL29430616 0.81 MAP4K4 (0.43) FASNCYP11B2KDM4EHPGDNPSR1
SCHEMBL24909443 0.77 KDM4E (0.44) FASNCYP11B2KDM4EHPGDNPSR1
SCHEMBL18587789 0.77 CTSS (0.43) FASNKDM4ECNR2MAOAMAOB
SCHEMBL18617449 0.77 CA3 (0.40) FASNCYP11B2CNR1CNR2ESR2
SCHEMBL29587766 0.77 CA3 (0.40) FASNCYP11B2CNR1CNR2ESR2
SCHEMBL5098919 0.76 MAOA (0.48) CYP11B2KDM4EHPGDNPSR1RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11352330-B2 Phenoxymethyl derivatives HOFFMANN-LA ROCHE INC. (US) 2022-06-07 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-11352330-B2 Phenoxymethyl derivatives CNKSR1, RB1, RCOR1 FASN 3999/4885CYP11B2 419/4885KDM4E 296/4885

“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.