SCHEMBL17307154

SCHEMBL17307154

CC(C)(C)c1c(Cl)ccc2[nH]cnc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.40
DPP8 Q6V1X1 1/20 0.40
LMNA P02545 2/20 0.38
ALDH1A1 P00352 2/20 0.37
PKM P14618 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
POLB P06746 1/20 0.37
AURKA O14965 2/20 0.35
DAPK3 O43293 2/20 0.35
PRKD3 O94806 2/20 0.35
MAP4K4 O95819 2/20 0.35
RET P07949 2/20 0.35
IGF1R P08069 2/20 0.35
PIM1 P11309 2/20 0.35
CLK2 P49760 2/20 0.35
GSK3A P49840 2/20 0.35
GSK3B P49841 2/20 0.35
PRKX P51817 2/20 0.35
BTK Q06187 2/20 0.35

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
SCHEMBL18405893 0.81 LMNA (0.38) DPP4LMNAALDH1A1PKMMEN1
SCHEMBL6364767 0.81 LMNA (0.38) DPP4DPP8LMNAALDH1A1PKM
SCHEMBL24854117 0.80 LMNA (0.37) DPP4DPP8LMNAALDH1A1PKM
SCHEMBL7348964 0.77 DPP4 (0.42) DPP4DPP8LMNAALDH1A1PKM
SCHEMBL4535246 0.76 DPP4 (0.44) DPP4DPP8LMNAALDH1A1PKM
SCHEMBL22380086 0.76 ALDH1A1 (0.40) DPP4DPP8LMNAALDH1A1PKM
SCHEMBL2362289 0.76 LMNA (0.34) DPP4LMNAALDH1A1PKMMEN1
SCHEMBL20975555 0.73 MAPT (0.43) DPP4DPP8LMNAALDH1A1PKM
SCHEMBL23478382 0.73 MAPT (0.36) DPP4DPP8ALDH1A1MEN1KMT2A
SCHEMBL17308779 0.73 DPP4 (0.49) DPP4DPP8LMNAALDH1A1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210002233-A1 PKM2 MODULATORS AND METHODS FOR THEIR USE SUMITOMO PHARMA ONCOLOGY, INC. 2021-01-07 US disclosed
US-10766865-B2 PKM2 modulators and methods for their use SUMITOMO DAINIPPON PHARMA ONCOLOGY, INC. (US) 2020-09-08 US disclosed
US-10472328-B2 PKM2 modulators and methods for their use TOLERO PHARMACEUTICALS, INC. (US) 2019-11-12 US disclosed
US-20190119219-A1 PKM2 MODULATORS AND METHODS FOR THEIR USE SUMITOMO PHARMA ONCOLOGY, INC. 2019-04-25 US disclosed
US-10207996-B2 PKM2 modulators and methods for their use TOLERO PHARMACEUTICALS, INC. (US) 2019-02-19 US disclosed
US-20170015631-A1 PKM2 MODULATORS AND METHODS FOR THEIR USE SUMITOMO PHARMA ONCOLOGY, INC. 2017-01-19 US disclosed
US-20170015631-A1 PKM2 MODULATORS AND METHODS FOR THEIR USE SUMITOMO PHARMA ONCOLOGY, INC. 2017-01-19 US disclosed
US-9394257-B2 PKM2 modulators and methods for their use TOLERO PHARMACEUTICALS, INC. (US) 2016-07-19 US disclosed
US-20150344436-A1 PKM2 MODULATORS AND METHODS FOR THEIR USE SUMITOMO PHARMA ONCOLOGY, INC. 2015-12-03 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 (7 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-10766865-B2 PKM2 modulators and methods for their use PDK1, PDK2, PKM DPP4 547/4885DPP8 632/4885LMNA 1822/4885
US-10472328-B2 PKM2 modulators and methods for their use PDK1, PDK2, PKM DPP4 547/4885DPP8 632/4885LMNA 1822/4885
US-20170015631-A1 PKM2 MODULATORS AND METHODS FOR THEIR USE PDK1, PDK2, PKM DPP4 547/4885DPP8 632/4885LMNA 1822/4885
US-10207996-B2 PKM2 modulators and methods for their use PDK1, PDK2, PKM DPP4 547/4885DPP8 632/4885LMNA 1822/4885
US-20190119219-A1 PKM2 MODULATORS AND METHODS FOR THEIR USE PDK1, PDK2, PKM DPP4 547/4885DPP8 632/4885LMNA 1822/4885
US-20210002233-A1 PKM2 MODULATORS AND METHODS FOR THEIR USE PDK1, PDK2, PKM DPP4 547/4885DPP8 632/4885LMNA 1822/4885
US-20150344436-A1 PKM2 MODULATORS AND METHODS FOR THEIR USE PDK1, PDK2, PKM DPP4 547/4885DPP8 632/4885LMNA 1822/4885

“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.