SCHEMBL5481597

SCHEMBL5481597

CCCCCCCCCCCCCCC(C[N+](C)(C)C)OP(=O)(O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.59
PTPN1 P18031 1/20 0.48
FDPS P14324 3/20 0.46
S1PR2 O95136 5/20 0.44
S1PR1 P21453 5/20 0.44
S1PR3 Q99500 5/20 0.44
S1PR4 O95977 4/20 0.44
MAPK1 P28482 2/20 0.43
CYP1A2 P05177 2/20 0.43
LAP3 P28838 1/20 0.43
MEN1 O00255 1/20 0.43
GMNN O75496 1/20 0.43
LMNA P02545 1/20 0.43
HSP90AA1 P07900 1/20 0.43
MAPT P10636 1/20 0.43
BLM P54132 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
NR1H4 Q96RI1 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL1044719 1.00 SMPD1 (0.59) SMPD1PTPN1FDPSS1PR2S1PR1
SCHEMBL596695 1.00 SMPD1 (0.59) SMPD1PTPN1FDPSS1PR2S1PR1
SCHEMBL744377 1.00 SMPD1 (0.59) SMPD1PTPN1FDPSS1PR2S1PR1
SCHEMBL27542771 1.00 SMPD1 (0.59) SMPD1PTPN1FDPSS1PR2S1PR1
SCHEMBL27835477 1.00 SMPD1 (0.59) SMPD1PTPN1FDPSS1PR2S1PR1
SCHEMBL27699114 1.00 SMPD1 (0.59) SMPD1PTPN1FDPSS1PR2S1PR1
Water SCHEMBL27411638 0.98 SMPD1 (0.57) SMPD1PTPN1FDPSS1PR2S1PR1
SCHEMBL8160746 0.98 SMPD1 (0.56) SMPD1PTPN1FDPSS1PR2S1PR1
SCHEMBL4064805 0.91 SMPD1 (0.50) SMPD1PTPN1S1PR2S1PR1S1PR3
SCHEMBL3332099 0.91 SMPD1 (0.50) SMPD1PTPN1S1PR2S1PR1S1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119451386-A Hole transport layer, perovskite solar cell and preparation method 天合光能股份有限公司 2025-02-14 CN claimed
US-8703179-B2 Mucosal formulation KIMBERLY-CLARK WORLDWIDE, INC. (US) 2014-04-22 US claimed
WO-2007133261-A1 MUCOSAL FORMULATION KIMBERLY-CLARK WORLDWIDE, INC. (US) 2007-11-22 WO claimed
US-20070264206-A1 Mucosal formulation KIMBERLY-CLARK WORLDWIDE, INC. 2007-11-15 US claimed
US-20050255556-A1 Refolding of ion channel proteins M-PHASYS GMBH (DE) 2005-11-17 US claimed
US-20260097150-A1 Implantable Device for Treating an Ocular Condition CELANESE EVA PERFORMANCE POLYMERS LLC (US) 2026-04-09 US disclosed
US-20260096984-A1 Implantable Device for Administering a Therapeutic Agent CELANESE EVA PERFORMANCE POLYMERS LLC (US) 2026-04-09 US disclosed
US-20260096985-A1 Injectable Composition For Drug Delivery CELANESE EVA PERFORMANCE POLYMERS LLC 2026-04-09 US disclosed
EP-4312951-A1 IMPLANTABLE MEDICAL DEVICE FOR THE DELIVERY OF NUCLEIC ACID-ENCAPSULATED PARTICLES Celanese EVA Performance Polymers LLC (US) 2024-02-07 EP disclosed
WO-2022212300-A1 IMPLANTABLE MEDICAL DEVICE FOR THE DELIVERY OF NUCLEIC ACID-ENCAPSULATED PARTICLES CELANESE EVA PERFORMANCE POLYMERS LLC (US) 2022-10-06 WO disclosed
US-20220313616-A1 Implantable Medical Device for the Delivery of Nucleic Acid-Encapsulated Particles CELANESE EVA PERFORMANCE POLYMERS LLC 2022-10-06 US disclosed
WO-2015193669-A1 DIAGNOSTIC AND THERAPEUTIC METHOD INVOLVING THE AUTOTAXIN-LYSOPHOSPHATIDIC ACID SIGNALLING PATHWAY BABRAHAM INSTITUTE (GB) 2015-12-23 WO disclosed
US-8703179-B2 Mucosal formulation KIMBERLY-CLARK WORLDWIDE, INC. (US) 2014-04-22 US disclosed
WO-2007133261-A1 MUCOSAL FORMULATION KIMBERLY-CLARK WORLDWIDE, INC. (US) 2007-11-22 WO disclosed
US-20070264206-A1 Mucosal formulation KIMBERLY-CLARK WORLDWIDE, INC. 2007-11-15 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 (4 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-20260097150-A1 Implantable Device for Treating an Ocular Condition P4HTM, ITGAM, TIMM44 SMPD1 2048/4885PTPN1 2486/4885FDPS 4440/4885
US-20260096984-A1 Implantable Device for Administering a Therapeutic Agent GHITM, O60361, P4HTM SMPD1 1091/4885PTPN1 1784/4885FDPS 4697/4885
US-20070264206-A1 Mucosal formulation MUC1, CHMP4B, VMA21 SMPD1 145/4885PTPN1 3955/4885FDPS 2883/4885
US-20260096985-A1 Injectable Composition For Drug Delivery SAMM50, OPRM1, IRAK4 SMPD1 1480/4885PTPN1 774/4885FDPS 3288/4885

“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.