SCHEMBL6283626

SCHEMBL6283626

CCCCCC(N)CCC(C)C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.56
PLA2G1B P04054 1/20 0.54
PLA2G2A P14555 1/20 0.54
S1PR2 O95136 5/20 0.48
S1PR1 P21453 5/20 0.48
S1PR3 Q99500 5/20 0.48
S1PR4 O95977 4/20 0.48
SPHK1 Q9NYA1 2/20 0.46
TP53 P04637 2/20 0.45
ALDH1A1 P00352 1/20 0.41
LAP3 P28838 2/20 0.40
CYP2D6 P10635 2/20 0.39
GMNN O75496 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
THPO P40225 1/20 0.39
MTOR P42345 1/20 0.39
BLM P54132 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL29186627 0.98 PLA2G1B (0.57) OPRM1PLA2G1BPLA2G2AS1PR2S1PR1
SCHEMBL6281344 0.98 PLA2G1B (0.57) OPRM1PLA2G1BPLA2G2AS1PR2S1PR1
SCHEMBL6279840 0.98 PLA2G1B (0.57) OPRM1PLA2G1BPLA2G2AS1PR2S1PR1
SCHEMBL24403199 0.92 OPRM1 (0.46) OPRM1PLA2G1BPLA2G2AS1PR2S1PR1
SCHEMBL7058526 0.92 OPRM1 (0.46) OPRM1PLA2G1BPLA2G2AS1PR2S1PR1
SCHEMBL28977213 0.90 PLA2G1B (0.59) OPRM1PLA2G1BPLA2G2AS1PR2S1PR1
SCHEMBL16371002 0.90 PLA2G1B (0.59) OPRM1PLA2G1BPLA2G2AS1PR2S1PR1
SCHEMBL21161889 0.90 PLA2G1B (0.59) OPRM1PLA2G1BPLA2G2AS1PR2S1PR1
SCHEMBL28446507 0.90 PLA2G1B (0.59) OPRM1PLA2G1BPLA2G2AS1PR2S1PR1
SCHEMBL15319803 0.90 PLA2G1B (0.59) OPRM1PLA2G1BPLA2G2AS1PR2S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220135513-A1 METHODS OF MANUFACTURING TREPROSTINIL AND TREPROSTINIL DERIVATIVE PRODRUGS BIOPHARMA CREDIT PLC (GB) 2022-05-05 US disclosed
US-6919291-B2 Fluorinated zwitterionic cocatalyst activators for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2005-07-19 US disclosed
US-20040110631-A1 Fluorinated zwitterionic cocatalyst activators for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2004-06-10 US disclosed
EP-1349653-A2 FLUORINATED ZWITTERIONIC COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION ExxonMobil Chemical Patents Inc. (US) 2003-10-08 EP disclosed
EP-0994108-B1 PROCESS FOR PRODUCING 2-HYDROXYBENZAMIDE DERIVATIVES ZERIA PHARM CO LTD (JP) 2003-05-14 EP disclosed
WO-2002036639-A2 FLUORINATED ZWITTERIONIC COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2002-05-10 WO disclosed
US-6197970-B1 REACTING WITH SECONDARY OR TERTIARY AMINE; DEBLOCKING, DEPROTECTING ZERIA PHARMACEUTICAL CO., LTD. (JP) 2001-03-06 US disclosed
EP-0994108-A1 PROCESS FOR PRODUCING 2-HYDROXYBENZAMIDE DERIVATIVES ZERIA PHARMACEUTICAL CO., LTD. (JP) 2000-04-19 EP 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 (2 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-20220135513-A1 METHODS OF MANUFACTURING TREPROSTINIL AND TREPROSTINIL DERIVATIVE PRODRUGS PTGIS, PTGER1, PTGIR OPRM1 2769/4885PLA2G1B 515/4885PLA2G2A 693/4885
US-20040110631-A1 Fluorinated zwitterionic cocatalyst activators for olefin polymerization FZD7, FOS, COG4 OPRM1 59/4885PLA2G1B 1285/4885PLA2G2A 825/4885

“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.