SCHEMBL915944

SCHEMBL915944

CC(=O)c1ccccc1Sc1cn(Cc2cc(F)cc(F)c2)c2cc(N(C)C(=O)OC(C)(C)C)ccc12

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.37
BRD4 O60885 2/20 0.36
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
NOD2 Q9HC29 1/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
MAPK1 P28482 2/20 0.33
PAX8 Q06710 1/20 0.33
SERPINE1 P05121 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
GAA P10253 1/20 0.31
ALDH1A1 P00352 3/20 0.31
GALR3 O60755 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL916200 0.93 BRD4 (0.36) POLBBRD4KMT2AMEN1MAPK1
SCHEMBL917748 0.93 KMT2A (0.36) POLBBRD4KMT2AMEN1MAPK1
SCHEMBL916311 0.92 BRD4 (0.35) POLBBRD4KMT2AMEN1MAPK1
SCHEMBL916638 0.89 BRD4 (0.39) POLBBRD4KMT2AMEN1MAPK1
SCHEMBL916730 0.89 BRD4 (0.39) POLBBRD4KMT2AMEN1MAPK1
SCHEMBL916614 0.88 GAA (0.36) POLBBRD4RAB9ANPC1KMT2A
SCHEMBL917442 0.86 BRD4 (0.35) POLBBRD4KMT2AMEN1MAPK1
SCHEMBL917282 0.84 BRD4 (0.36) POLBBRD4KMT2AMEN1MAPK1
SCHEMBL716247 0.79 SLC6A4 (0.33) POLBKMT2AMEN1MAPK1L3MBTL1
SCHEMBL916224 0.78 L3MBTL1 (0.34) BRD4RAB9AKMT2AMEN1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009428-A1 NOVEL ANDROGENS N.V. ORGANON (NL) 2011-01-13 US disclosed
US-7812036-B2 Androgens N.V. ORGANON (NL) 2010-10-12 US disclosed
EP-1742912-B1 NOVEL ANDROGENS ORGANON NV (NL) 2010-08-25 EP disclosed
US-20070225352-A1 Novel Androgens PHARMACOPELA DRUG DISCOVERY, INC. (US) 2007-09-27 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 (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-20070225352-A1 Novel Androgens NR5A1, AR, SHBG POLB 4152/4885BRD4 867/4885RAB9A 4165/4885
US-20110009428-A1 NOVEL ANDROGENS NR5A1, AR, NR3C2 POLB 3139/4885BRD4 688/4885RAB9A 3954/4885

“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.