SCHEMBL4241209

SCHEMBL4241209

COC(=O)c1ccc(NC(=O)c2ccc(F)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 1.00
NPC1 O15118 4/20 1.00
ATM Q13315 1/20 1.00
MEN1 O00255 6/20 0.78
KMT2A Q03164 6/20 0.78
MAPK1 P28482 2/20 0.78
MAPT P10636 1/20 0.78
HTT P42858 1/20 0.78
KDM4E B2RXH2 1/20 0.77
PTPN1 P18031 2/20 0.69
MITF O75030 1/20 0.67
POLB P06746 2/20 0.61
TDP1 Q9NUW8 1/20 0.61
PSMD14 O00487 1/20 0.60
CACNA1B Q00975 1/20 0.60
APBA1 Q02410 1/20 0.60
SNCA P37840 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP2D6 P10635 1/20 0.59
TSHR P16473 1/20 0.59

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
SCHEMBL3637607 1.00 RAB9A (1.00) RAB9ANPC1ATMMEN1KMT2A
SCHEMBL6263820 0.91 NPC1 (0.83) RAB9ANPC1ATMMEN1KMT2A
SCHEMBL8660366 0.91 NPC1 (0.83) RAB9ANPC1ATMMEN1KMT2A
SCHEMBL4111942 0.88 MAPT (1.00) RAB9ANPC1ATMMEN1KMT2A
SCHEMBL10684470 0.87 PTPN1 (0.88) RAB9ANPC1ATMMEN1KMT2A
SCHEMBL63811 0.85 MAPT (0.75) RAB9ANPC1ATMMEN1KMT2A
SCHEMBL6295993 0.85 NPC1 (0.83) RAB9ANPC1ATMMEN1KMT2A
SCHEMBL4609805 0.84 NPC1 (0.79) RAB9ANPC1ATMMEN1KMT2A
SCHEMBL2834528 0.84 PTPN1 (0.73) RAB9ANPC1ATMMEN1KMT2A
SCHEMBL62930 0.84 PTPN1 (0.90) RAB9ANPC1ATMMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023122212-A2 SUBSTITUTED PHENYL ETHYNYL PYRIDINE CARBOXAMIDES AS POTENT INHIBITORS OF SARS VIRUS SOUTHERN RESEARCH INSTITUTE (US) 2023-06-29 WO disclosed
US-20230192733-A1 SUBSTITUTED PHENYL ET458HYNYL PYRIDINE CARBOXAMIDES AS POTENT INHIBITORS OF SARS VIRUS SOUTHERN RESEARCH INSTITUTE 2023-06-22 US disclosed
US-20090105217-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2009-04-23 US disclosed
US-20090105217-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2009-04-23 US disclosed
US-20090105217-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2009-04-23 US disclosed
WO-2007138033-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2007-12-06 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 (2 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-20090105217-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS CHRNA7, CHRNA5, CHRNA2 RAB9A 2045/4885NPC1 1641/4885ATM 3200/4885
US-20230192733-A1 SUBSTITUTED PHENYL ET458HYNYL PYRIDINE CARBOXAMIDES AS POTENT INHIBITORS OF SARS VIRUS SARS1, ACE2, ACE RAB9A 974/4885NPC1 1410/4885ATM 879/4885

“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.