SCHEMBL20511448

SCHEMBL20511448

Clc1nc(Cl)nc(NCC2CCCCC2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.42
LMNA P02545 1/20 0.41
IDH1 O75874 1/20 0.38
AOC1 P19801 1/20 0.38
AOC3 Q16853 1/20 0.38
APP P05067 1/20 0.38
PTGS2 P35354 1/20 0.38
VCP P55072 3/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CDC7 O00311 1/20 0.36
ROCK2 O75116 1/20 0.36
CCNB2 O95067 1/20 0.36
MAP4K4 O95819 1/20 0.36
CDK1 P06493 1/20 0.36
RET P07949 1/20 0.36
CCNB1 P14635 1/20 0.36
PRKACA P17612 1/20 0.36
CDK2 P24941 1/20 0.36
GSK3B P49841 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
SCHEMBL20814491 0.86 LMNA (0.50) PDE4ALMNAIDH1VCPKMT2A
SCHEMBL8054361 0.86 IDH1 (0.46) IDH1AOC1AOC3APPPTGS2
SCHEMBL15720156 0.84 PDE4A (0.41) PDE4ALMNAIDH1PTGS2VCP
SCHEMBL24167944 0.81 KMT2A (0.40) PDE4ALMNAKMT2AGSK3BCA2
SCHEMBL29197980 0.81 KCNH3 (0.54) LMNAPTGS2VCP
SCHEMBL23431616 0.78 GAA (0.61) PDE4ALMNAMEN1KMT2A
SCHEMBL8039831 0.77 APP (0.51) IDH1AOC1AOC3APPPTGS2
SCHEMBL8053409 0.77 APP (0.51) IDH1AOC1AOC3APPPTGS2
SCHEMBL10168927 0.75 KMT2A (0.57) LMNAIDH1MEN1KMT2A
SCHEMBL26819168 0.75 KCNH3 (0.44) LMNAPTGS2

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-10814010-B2 FOXC2 inhibitor and methods of use thereof THE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2020-10-27 US disclosed
WO-2020146779-A1 mTORC1 INHIBITORS FOR ACTIVATING AUTOPHAGY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-07-16 WO disclosed
US-20190290774-A1 FOXC2 INHIBITOR AND METHODS OF USE THEREOF POHANG UNIVERSITY OF SCIENCE AND TECHNOLOGY (KR) 2019-09-26 US disclosed
WO-2018175958-A1 THIOREDOXIN MODULATORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-09-27 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 (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-20190290774-A1 FOXC2 INHIBITOR AND METHODS OF USE THEREOF FOXK1, FOXO1, NCOA2 PDE4A 2741/4885LMNA 3070/4885IDH1 1012/4885
US-10814010-B2 FOXC2 inhibitor and methods of use thereof FOXK1, FOXO1, NCOA2 PDE4A 2741/4885LMNA 3070/4885IDH1 1012/4885

“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.