SCHEMBL23745698

SCHEMBL23745698

Cc1cccc(C(CC(=O)NCC2CCC(CN)CC2)c2cn(CC3CCCCC3)c3ccccc23)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.43
NPC1 O15118 1/20 0.43
ICMT O60725 1/20 0.41
P2RX7 Q99572 1/20 0.40
BCHE P06276 3/20 0.39
MAPT P10636 1/20 0.39
TPSAB1 Q15661 1/20 0.37
CYP2D6 P10635 1/20 0.37
F10 P00742 3/20 0.36
F2 P00734 1/20 0.36
PRSS1 P07477 1/20 0.36
OPRK1 P41145 1/20 0.35

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
SCHEMBL23745701 1.00 CNR1 (0.43) CNR1NPC1ICMTP2RX7BCHE
SCHEMBL23745792 0.94 CNR1 (0.43) CNR1NPC1ICMTP2RX7BCHE
SCHEMBL23745791 0.94 CNR1 (0.43) CNR1NPC1ICMTP2RX7BCHE
SCHEMBL23745772 0.91 ICMT (0.41) CNR1NPC1ICMTBCHECYP2D6
SCHEMBL23745738 0.91 CNR1 (0.41) CNR1ICMTMAPTTPSAB1
SCHEMBL23745737 0.91 CNR1 (0.41) CNR1ICMTMAPTTPSAB1
Hydrochloric Acid SCHEMBL23721941 0.90 CNR1 (0.41) CNR1ICMTMAPTTPSAB1
SCHEMBL23745845 0.86 CNR1 (0.39) CNR1ICMTP2RX7BCHEMAPT
SCHEMBL23721913 0.86 CNR1 (0.39) CNR1ICMTP2RX7BCHEMAPT
SCHEMBL23745723 0.85 CNR1 (0.44) CNR1ICMTMAPTTPSAB1

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 CNR1 1651/4885NPC1 564/4885ICMT 345/4885

“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.