SCHEMBL6844273

SCHEMBL6844273

O=S(=O)(Nc1ccc2c(ccn2-c2cccnc2)c1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 3/20 0.57
BRD1 O95696 2/20 0.57
BRPF1 P55201 2/20 0.57
BRD9 Q9H8M2 2/20 0.57
BRPF3 Q9ULD4 1/20 0.57
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
TRIM24 O15164 1/20 0.48
ALDH1A1 P00352 3/20 0.47
JAK2 O60674 1/20 0.45
MAPK1 P28482 1/20 0.44
HPGD P15428 3/20 0.44
PKM P14618 1/20 0.44
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PIK3CA P42336 1/20 0.43

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
SCHEMBL6840912 0.90 POLB (0.54) BRD4BRD1BRPF1BRD9BRPF3
SCHEMBL6656125 0.90 MEN1 (0.57) BRD4BRD1BRPF1BRD9BRPF3
SCHEMBL6665282 0.88 LMNA (0.45) BRD4BRD1BRPF1BRD9BRPF3
SCHEMBL6847813 0.87 KEAP1 (0.60) BRD4BRD1BRPF1BRD9BRPF3
SCHEMBL6846145 0.87 ALDH1A1 (0.60) BRD4BRD1BRPF1BRD9BRPF3
SCHEMBL6659457 0.87 KMT2A (0.48) BRD4BRD1BRPF1BRD9BRPF3
SCHEMBL6658847 0.87 BRPF1 (0.60) BRD4BRD1BRPF1BRD9BRPF3
SCHEMBL6844284 0.87 BRD1 (0.53) BRD4BRD1BRPF1BRD9BRPF3
SCHEMBL6845454 0.87 KMT2A (0.51) BRD4BRD1BRPF1BRD9BRPF3
SCHEMBL6844486 0.86 KMT2A (0.47) BRD4BRD1BRPF1BRD9BRPF3

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-20040236110-A1 Substituted 3-pyridyl indoles and indazoles as c17,20 lyase inhibitors BAYER PHARMACEUTICALS CORPORATION 2004-11-25 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-20040236110-A1 Substituted 3-pyridyl indoles and indazoles as c17,20 lyase inhibitors CYP17A1, IDO1, CYP21A2 BRD4 1450/4885BRD1 1341/4885BRPF1 2930/4885

“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.