SCHEMBL24548858

SCHEMBL24548858

O=P(O)(O)CN1CCCNCCNCCCNCC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 13/20 0.53
MEN1 O00255 1/20 0.47
CHRM2 P08172 1/20 0.47
CHRM1 P11229 1/20 0.47
ADRA2C P18825 1/20 0.47
CCR2 P41597 1/20 0.47
CXCL12 P48061 1/20 0.47
BLM P54132 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
MAPT P10636 2/20 0.44
ANPEP P15144 1/20 0.40
ERAP2 Q6P179 1/20 0.40
SIGMAR1 Q99720 2/20 0.37
CHRM5 P08912 1/20 0.35
CHRM3 P20309 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
SCHEMBL13805263 0.96 CXCR4 (0.47) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL13805262 0.93 CXCR4 (0.44) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL8393831 0.90 MAPT (0.49) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL9041381 0.90 MAPT (0.49) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL7453394 0.88 MAPT (0.50) CXCR4MEN1KMT2AMAPTANPEP
SCHEMBL336756 0.88 MAPT (0.50) CXCR4MEN1KMT2AMAPTANPEP
SCHEMBL22355301 0.86 MAPT (0.47) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL336114 0.86 MAPT (0.49) CXCR4MEN1KMT2AMAPTANPEP
Hydrochloric Acid SCHEMBL31341457 0.86 MAPT (0.49) CXCR4MEN1KMT2AMAPTANPEP
SCHEMBL472195 0.86 MAPT (0.49) CXCR4MEN1KMT2AMAPTANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4590670-A1 PLATFORM AND SCAFFOLD FOR FAP TARGETING AGENTS Erasmus University Rotterdam Medical Center (NL) 2025-07-30 EP disclosed
US-20240141517-A1 IMPROVEMENTS IN ELECTROCHEMICAL REDUCTION OF CARBON DIOXIDE THE UNIVERSITY OF LIVERPOOL (GB) 2024-05-02 US disclosed
WO-2024063648-A1 Platform and scaffold for FAP targeting agents ERASMUS UNIVERSITY MEDICAL CENTER ROTTERDAM (NL) 2024-03-28 WO disclosed
EP-4247999-A1 IMPROVEMENTS IN ELECTROCHEMICAL REDUCTION OF CARBON DIOXIDE THE UNIVERSITY OF LIVERPOOL (GB) 2023-09-27 EP disclosed
WO-2022129895-A1 IMPROVEMENTS IN ELECTROCHEMICAL REDUCTION OF CARBON DIOXIDE THE UNIVERSITY OF LIVERPOOL (GB) 2022-06-23 WO disclosed
WO-2022129895-A1 IMPROVEMENTS IN ELECTROCHEMICAL REDUCTION OF CARBON DIOXIDE THE UNIVERSITY OF LIVERPOOL (GB) 2022-06-23 WO disclosed