SCHEMBL29923352

SCHEMBL29923352

CCc1cc(C(=O)NCC2CNC2)c2ncccc2c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 5/20 0.45
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
PBK Q96KB5 5/20 0.42
LMNA P02545 3/20 0.41
TP53 P04637 2/20 0.41
PARP1 P09874 1/20 0.41
CCR3 P51677 1/20 0.40
SSTR1 P30872 1/20 0.39
SSTR4 P31391 1/20 0.39
THRB P10828 1/20 0.39
PDE6D O43924 1/20 0.38
PDE6A P16499 1/20 0.38
PDE6G P18545 1/20 0.38
PDE6B P35913 1/20 0.38
PDE6C P51160 1/20 0.38
PDE6H Q13956 1/20 0.38
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38

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
SCHEMBL29923702 0.85 EGLN1 (0.46) EGLN1CNR1CNR2PARP1SSTR1
SCHEMBL29923590 0.85 EGLN1 (0.42) EGLN1CNR1CNR2LMNATP53
SCHEMBL24916011 0.80 PBK (0.38) CNR2PBK
SCHEMBL29923860 0.80 PARP1 (0.49) EGLN1PARP1
SCHEMBL29923816 0.79 EGLN1 (0.54) EGLN1PARP1
SCHEMBL29923336 0.78 EGLN1 (0.52) EGLN1LMNA
SCHEMBL29923768 0.77 EGLN1 (0.52) EGLN1
SCHEMBL29923470 0.76 EGLN1 (0.51) EGLN1PARP1
SCHEMBL29923343 0.75 PARP1 (0.52) EGLN1LMNAPARP1
SCHEMBL29923798 0.74 NPC1 (0.52) EGLN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230026466-A1 WDR5 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY 2023-01-26 US disclosed
EP-4055013-A1 WDR5 INHIBITORS AND MODULATORS Vanderbilt University (US) 2022-09-14 EP 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 (1 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-20230026466-A1 WDR5 INHIBITORS AND MODULATORS WDR5, WDR1, WDR3 EGLN1 1068/4885CNR1 3395/4885CNR2 3646/4885

“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.