SCHEMBL6656738

SCHEMBL6656738

O=S(=O)(Nc1ccc2c(ccn2-c2cccnc2)c1)c1cccc(F)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALPL P05186 3/20 0.45
SGK1 O00141 1/20 0.41
CCR4 P51679 1/20 0.40
ALDH1A1 P00352 3/20 0.39
NR1I2 O75469 2/20 0.39
LMNA P02545 1/20 0.39
BRD1 O95696 1/20 0.38
BRPF1 P55201 1/20 0.38
HTR6 P50406 2/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
NTSR1 P30989 2/20 0.37
TP53 P04637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
PIK3C3 Q8NEB9 1/20 0.36

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
SCHEMBL6840520 0.90 ALPL (0.46) ALPLSGK1ALDH1A1NR1I2LMNA
SCHEMBL6656751 0.84 ALPL (0.49) ALPLSGK1LMNAMEN1KMT2A
SCHEMBL7028408 0.82 ALDH1A1 (0.58) ALPLALDH1A1NR1I2LMNABRD1
SCHEMBL6659042 0.81 SLC22A12 (0.51)
SCHEMBL6665282 0.81 LMNA (0.45) LMNABRD1BRPF1MEN1KMT2A
SCHEMBL6844486 0.81 KMT2A (0.47) ALPLLMNABRD1BRPF1HTR6
SCHEMBL6656125 0.81 MEN1 (0.57) ALDH1A1LMNABRD1BRPF1MEN1
SCHEMBL6844273 0.79 BRD4 (0.57) ALDH1A1LMNABRD1BRPF1MEN1
SCHEMBL6845979 0.78 BRPF1 (0.53) ALDH1A1BRD1BRPF1MEN1KMT2A
SCHEMBL6840912 0.76 POLB (0.54) ALPLALDH1A1LMNABRD1BRPF1

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-20040236110-A1 Substituted 3-pyridyl indoles and indazoles as c17,20 lyase inhibitors BAYER PHARMACEUTICALS CORPORATION 2004-11-25 US disclosed
EP-1432698-A2 SUBSTITUTED 3-PYRIDYL INDOLES AND INDAZOLES AS C17,20 LYASE INHIBITORS Bayer Pharmaceuticals Corporation (US) 2004-06-30 EP disclosed
WO-2003027094-A2 SUBSTITUTED 3-PYRIDYL INDOLES AND INDAZOLES AS C17,20 LYASE INHIBITORS BAYER PHARMACEUTICALS CORPORATION (US) 2003-04-03 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 (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-20040236110-A1 Substituted 3-pyridyl indoles and indazoles as c17,20 lyase inhibitors CYP17A1, IDO1, CYP21A2 ALPL 1159/4885SGK1 2113/4885CCR4 3552/4885

“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.