SCHEMBL11922249

SCHEMBL11922249

Nc1cc(Cl)nc(Cl)c1C(=O)NCc1ccc(F)c(F)c1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
CHRM4 P08173 1/20 0.48
MAOB P27338 1/20 0.45
S1PR3 Q99500 5/20 0.44
PPARG P37231 4/20 0.43
MMP13 P45452 1/20 0.43
NPC1 O15118 1/20 0.42
MET P08581 1/20 0.42
ADORA2A P29274 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
KLKB1 P03952 1/20 0.40

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
SCHEMBL1585753 0.83 PPARG (0.47) MEN1KMT2ACHRM4MAOBS1PR3
SCHEMBL20402622 0.76 MEN1 (0.54) MEN1KMT2ACHRM4MAOBS1PR3
SCHEMBL2128166 0.73 KMT2A (0.81) MEN1KMT2ACHRM4NPC1TAAR1
SCHEMBL1585418 0.73 PPARG (0.47) MEN1KMT2ACHRM4MAOBS1PR3
SCHEMBL30309968 0.73 PPARG (0.47) MEN1KMT2ACHRM4MAOBS1PR3
SCHEMBL2128569 0.73 KMT2A (1.00) MEN1KMT2ACHRM4NPC1TAAR1
SCHEMBL14743597 0.72 PPARG (0.55) CHRM4MAOBS1PR3PPARGMMP13
SCHEMBL1585196 0.71 NPC1 (0.42) MEN1KMT2ANPC1TAAR1CA1
SCHEMBL2129852 0.71 MEN1 (0.67) MEN1KMT2ACHRM4MAOBNPC1
SCHEMBL507217 0.71 PPARG (0.56) MEN1KMT2AMAOBPPARGMMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210070752-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS VIRACTA THERAPEUTICS, INC. 2021-03-11 US disclosed
US-20190119268-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS SUNESIS PHARMACEUTICALS, INC. 2019-04-25 US disclosed
US-10030016-B2 Heterocyclic compounds useful as PDK1 inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2018-07-24 US disclosed
US-10030016-B2 Heterocyclic compounds useful as PDK1 inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2018-07-24 US disclosed
US-9546165-B2 Heterocyclic compounds useful as PDK1 inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2017-01-17 US disclosed
US-9546165-B2 Heterocyclic compounds useful as PDK1 inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2017-01-17 US disclosed
US-20160331756-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2016-11-17 US disclosed
US-20160331756-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2016-11-17 US disclosed
US-20120208819-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2012-08-16 US disclosed
US-20120208819-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2012-08-16 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 (5 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-20120208819-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS PDK1, PDK2, PDK3 MEN1 1673/4885KMT2A 1654/4885CHRM4 4749/4885
US-20210070752-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS PDK1, PDK2, PDK3 MEN1 1673/4885KMT2A 1654/4885CHRM4 4749/4885
US-10030016-B2 Heterocyclic compounds useful as PDK1 inhibitors PDK1, PDK2, PDK3 MEN1 1673/4885KMT2A 1654/4885CHRM4 4749/4885
US-20160331756-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS PDK1, PDK2, PDK3 MEN1 1673/4885KMT2A 1654/4885CHRM4 4749/4885
US-20190119268-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS PDK1, PDK2, PDK3 MEN1 1673/4885KMT2A 1654/4885CHRM4 4749/4885

“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.