SCHEMBL5366579

SCHEMBL5366579

CCCc1ccc(C(=O)N(CC)CC)c(-c2cccc(F)c2F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.41
KEAP1 Q14145 1/20 0.40
HPGD P15428 2/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
ALOX5AP P20292 1/20 0.40
FEN1 P39748 1/20 0.40
HCRTR1 O43613 3/20 0.37
HCRTR2 O43614 3/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
SORT1 Q99523 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
RARB P10826 2/20 0.36
CYP2D6 P10635 1/20 0.36
OPRD1 P41143 1/20 0.36
KCNH2 Q12809 1/20 0.36
RARA P10276 1/20 0.36
RARG P13631 1/20 0.36
KAT6A Q92794 1/20 0.35

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
SCHEMBL4462445 0.72 CYP3A4 (0.50) HPGDMAPK1NPC1RAB9A
SCHEMBL14052340 0.71 KEAP1 (0.55) PARP1KEAP1HPGDLMNAMAPK1
SCHEMBL5371571 0.71 LPL (0.42) HPGDLMNACNR1CNR2TDP1
SCHEMBL3557705 0.70 MEN1 (0.41) HPGDLMNAMAPK1CNR1CNR2
SCHEMBL4469757 0.68 HSP90AA1 (0.45) PARP1KEAP1HPGDMAPK1ALOX5AP
SCHEMBL14529999 0.68 TSHR (0.47) PARP1KEAP1HPGDMAPK1ALOX5AP
SCHEMBL9226854 0.68 HTR7 (0.48) KAT6A
SCHEMBL22011230 0.68 GPR3 (0.48) RARBRARARARG
SCHEMBL1599469 0.68 HDAC3 (0.48) RARBPPARGNPC1GAARAB9A
SCHEMBL254969 0.67 ALDH1A1 (0.56) KEAP1HPGDLMNAMAPK1ALOX5AP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7297379-B2 Polyfluorinated fused aromatics and their use in liquid-crystal mixtures MERCK PATENT GMBH (DE) 2007-11-20 US disclosed
US-20050255258-A1 Polyfluorinated fused aromatics and their use in liquid-crystal mixtures MERCK PATENT GMBH (DE) 2005-11-17 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-20050255258-A1 Polyfluorinated fused aromatics and their use in liquid-crystal mixtures SCO2, CHRM1, CBR1 PARP1 987/4885KEAP1 2133/4885HPGD 3247/4885

“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.