SCHEMBL4154655

SCHEMBL4154655

CCCNC(=O)c1cc(F)ccc1C

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
THRB P10828 1/20 0.49
RECQL P46063 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ALDH1A1 P00352 4/20 0.48
KCNA3 P22001 1/20 0.46
P2RX7 Q99572 1/20 0.45
HSD17B10 Q99714 2/20 0.44
KMT2A Q03164 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
NAMPT P43490 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
KDM4E B2RXH2 1/20 0.42
BCHE P06276 1/20 0.41

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
SCHEMBL14454130 0.87 POLB (0.53) POLBL3MBTL1THRBRECQLTDP1
SCHEMBL1911846 0.87 P2RX7 (0.44) L3MBTL1P2RX7HTTBCHE
SCHEMBL13753137 0.85 L3MBTL1 (0.54) POLBL3MBTL1THRBRECQLTDP1
SCHEMBL13753140 0.82 L3MBTL1 (0.54) POLBL3MBTL1THRBRECQLTDP1
SCHEMBL15630980 0.81 RAB9A (0.50) POLBTDP1ALDH1A1P2RX7KMT2A
SCHEMBL13614177 0.80 POLB (0.47) POLBL3MBTL1THRBRECQLTDP1
SCHEMBL14454228 0.79 POLB (0.51) POLBL3MBTL1THRBRECQLTDP1
SCHEMBL15828698 0.78 ESRRG (0.50) POLBL3MBTL1THRBRECQLTDP1
SCHEMBL1668369 0.78 ALDH1A1 (0.46) POLBL3MBTL1THRBRECQLTDP1
SCHEMBL11636186 0.78 GAA (0.48) POLBALDH1A1KMT2AHPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105292-A9 Glucocorticoid Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2009-04-23 US disclosed
US-20070281959-A1 Glucocorticoid receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2007-12-06 US disclosed
CN-1950375-A Glucocorticoid receptor modulator compounds and methods- utility LIGAND PHARM INC (US) 2007-04-18 CN 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-20090105292-A9 Glucocorticoid Receptor Modulator Compounds and Methods NR3C1, NR3C2, MC2R POLB 3867/4885L3MBTL1 4786/4885THRB 259/4885
US-20070281959-A1 Glucocorticoid receptor modulator compounds and methods NR3C1, NR3C2, MC2R POLB 3867/4885L3MBTL1 4786/4885THRB 259/4885

“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.