SCHEMBL23745589

SCHEMBL23745589

Cc1cccc(C(CC(=O)NC2CCC(N)CC2)c2cn(CC3CCCCC3)c3ccc(-c4ccnn4C)cc23)c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ICMT O60725 4/20 0.40
CNR1 P21554 3/20 0.36
CNR2 P34972 3/20 0.34
CTSA P10619 1/20 0.34
MAPK1 P28482 1/20 0.34
GRIN2B Q13224 2/20 0.33
LIPG Q9Y5X9 1/20 0.33
CTSD P07339 1/20 0.33
KMT2A Q03164 1/20 0.33
PIN1 Q13526 2/20 0.33

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
Hydrochloric Acid SCHEMBL23721960 0.99 ICMT (0.40) ICMTCNR1CNR2CTSAMAPK1
SCHEMBL23745764 0.89 ICMT (0.44) ICMTCNR1CNR2GRIN2BKMT2A
SCHEMBL23745742 0.89 ICMT (0.48) ICMTCNR1CNR2GRIN2BKMT2A
SCHEMBL23722107 0.89 ICMT (0.48) ICMTCNR1CNR2GRIN2BKMT2A
Hydrochloric Acid SCHEMBL23721981 0.89 ICMT (0.43) ICMTCNR1CNR2GRIN2BKMT2A
Hydrochloric Acid SCHEMBL23721849 0.88 ICMT (0.47) ICMTCNR1CNR2GRIN2BKMT2A
SCHEMBL23745854 0.86 ICMT (0.42) ICMTCNR1CNR2GRIN2BKMT2A
SCHEMBL23745855 0.86 ICMT (0.42) ICMTCNR1CNR2GRIN2BKMT2A
SCHEMBL23745783 0.86 ICMT (0.40) ICMTCNR1CNR2GRIN2BKMT2A
SCHEMBL23745777 0.86 ICMT (0.40) ICMTCNR1CNR2GRIN2BKMT2A

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 1 patent. 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

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 ICMT 345/4885CNR1 1651/4885CNR2 2528/4885

“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.