SCHEMBL17154394

SCHEMBL17154394

Nc1ccc(Nc2c3ccccc3nc3cc(N)ccc23)cc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 13/20 0.84
KMT2A Q03164 4/20 0.55
POLB P06746 3/20 0.55
RAD52 P43351 3/20 0.55
GFER P55789 2/20 0.55
TOP2A P11388 1/20 0.55
TOP2B Q02880 1/20 0.55
ATM Q13315 1/20 0.54
KDM4E B2RXH2 2/20 0.52
MAPT P10636 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
MEN1 O00255 2/20 0.52
GLA P06280 1/20 0.52
MAPK1 P28482 1/20 0.52
HTT P42858 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
MITF O75030 1/20 0.52
LMNA P02545 1/20 0.52
RECQL P46063 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL17154453 0.92 KDM1A (0.69) KDM1AKMT2APOLBRAD52GFER
SCHEMBL17154450 0.92 KDM1A (1.00) KDM1AKMT2APOLBRAD52GFER
SCHEMBL31237457 0.86 KDM1A (0.78) KDM1AKMT2ARAD52GFERTOP2A
SCHEMBL17154399 0.86 KDM1A (0.62) KDM1AKMT2APOLBRAD52TOP2A
SCHEMBL17154363 0.83 KDM1A (0.58) KDM1AKMT2APOLBRAD52GFER
SCHEMBL17154392 0.83 KMT2A (0.74) KDM1AKMT2APOLBKDM4EMAPT
SCHEMBL17154362 0.83 KDM1A (0.74) KDM1AKMT2APOLBRAD52ATM
SCHEMBL17154397 0.81 KDM1A (0.68) KDM1AKMT2APOLBRAD52GFER
SCHEMBL15764151 0.81 KDM1A (0.54) KDM1AKMT2APOLBRAD52TOP2A
SCHEMBL18407164 0.80 TOP2A (0.73) KDM1AKMT2APOLBRAD52GFER

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-10183912-B2 HDMX inhibitors and their use for cancer treatment MiRx Pharmaceuticals, LLC (US) 2019-01-22 US disclosed
US-20170022166-A1 NOVEL HDMX INHIBITORS AND THEIR USE FOR CANCER TREATMENT MIRX PHARMACEUTICALS LLC (US) 2017-01-26 US disclosed
US-20170022166-A1 NOVEL HDMX INHIBITORS AND THEIR USE FOR CANCER TREATMENT MIRX PHARMACEUTICALS LLC (US) 2017-01-26 US disclosed
WO-2015153535-A1 NOVEL HDMX INHIBITORS AND THEIR USE FOR CANCER TREATMENT MiRx Pharmaceuticals, LLC (US) 2015-10-08 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-20170022166-A1 NOVEL HDMX INHIBITORS AND THEIR USE FOR CANCER TREATMENT TP53, DDX3X, API5 KDM1A 702/4885KMT2A 1544/4885POLB 3707/4885
US-10183912-B2 HDMX inhibitors and their use for cancer treatment TP53, MDM4, MDM2 KDM1A 650/4885KMT2A 1514/4885POLB 3690/4885

“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.