SCHEMBL23721908

SCHEMBL23721908

Cc1cccc(C(CCNC2CCNCC2)c2cn(CC3CCOCC3)c3ccc(C#N)cc23)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.44
CNR1 P21554 6/20 0.44
SOS1 Q07889 1/20 0.39
PFKFB2 O60825 1/20 0.34
PFKFB1 P16118 1/20 0.34
PFKFB3 Q16875 1/20 0.34
KDM1A O60341 6/20 0.33
OPRL1 P41146 1/20 0.32
EGFR P00533 1/20 0.31
RET P07949 1/20 0.31
IGF1R P08069 1/20 0.31
PDGFRB P09619 1/20 0.31
SRC P12931 1/20 0.31
PDGFRA P16234 1/20 0.31
FLT1 P17948 1/20 0.31
LTK P29376 1/20 0.31
AXL P30530 1/20 0.31
KDR P35968 1/20 0.31
FLT3 P36888 1/20 0.31
MST1R Q04912 1/20 0.31

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
SCHEMBL23722038 0.95 SOS1 (0.41) CNR2CNR1SOS1KDM1A
SCHEMBL23745833 0.92 CNR2 (0.44) CNR2CNR1PFKFB2PFKFB1PFKFB3
Hydrochloric Acid SCHEMBL23721937 0.91 CNR2 (0.43) CNR2CNR1PFKFB2PFKFB1PFKFB3
SCHEMBL23745604 0.89 CNR2 (0.42) CNR2CNR1SOS1
SCHEMBL23745598 0.89 SOS1 (0.44) CNR2CNR1SOS1
Hydrochloric Acid SCHEMBL23722144 0.89 CNR2 (0.41) CNR2CNR1SOS1
Hydrochloric Acid SCHEMBL23722114 0.88 SOS1 (0.44) CNR2CNR1SOS1
SCHEMBL23745522 0.85 CNR2 (0.44) CNR2CNR1PFKFB2PFKFB1PFKFB3
Hydrochloric Acid SCHEMBL23722112 0.84 CNR2 (0.44) CNR2CNR1PFKFB2PFKFB1PFKFB3
SCHEMBL23745514 0.83 SOS1 (0.48) CNR1SOS1

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-20210246115-A1 ANTI-INFECTIVE HETEROCYCLIC COMPOUNDS AND USES THEREOF BIOIMICS AB (SE) 2021-08-12 US disclosed
US-20210246115-A1 ANTI-INFECTIVE HETEROCYCLIC COMPOUNDS AND USES THEREOF BIOIMICS AB (SE) 2021-08-12 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 (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-20210246115-A1 ANTI-INFECTIVE HETEROCYCLIC COMPOUNDS AND USES THEREOF FDPS, FPR1, F12 CNR2 2528/4885CNR1 1651/4885SOS1 2902/4885

“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.