SCHEMBL3093271

SCHEMBL3093271

CCCCCN1CCNC(CC)C1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 8/20 0.42
GNAI3 P08754 7/20 0.42
GNAI1 P63096 7/20 0.42
GUSB P08236 2/20 0.41
EBP Q15125 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
BCHE P06276 2/20 0.39
HTR1A P08908 2/20 0.38
DRD1 P21728 2/20 0.38
DRD4 P21917 2/20 0.38
DRD5 P21918 2/20 0.38
DRD3 P35462 2/20 0.38
SOD3 P08294 1/20 0.38
DRD2 P14416 1/20 0.38

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
SCHEMBL292674 0.98 GNAO1 (0.45) GNAO1GNAI3GNAI1GUSBEBP
SCHEMBL3109275 0.95 GLB1 (0.40) GNAO1GNAI3GNAI1EBPSIGMAR1
SCHEMBL294048 0.87 DRD3 (0.34) EBPSIGMAR1DRD1DRD4DRD5
SCHEMBL294119 0.86 GNAO1 (0.41) GNAO1GNAI3GNAI1GUSBEBP
SCHEMBL2702582 0.85 GNAO1 (0.43) GNAO1GNAI3GNAI1GUSBEBP
SCHEMBL4759046 0.82 GNAO1 (0.38) GNAO1GNAI3GNAI1GUSBEBP
SCHEMBL3099250 0.81 EBP (0.47) GNAO1GNAI3GNAI1GUSBEBP
SCHEMBL25118371 0.81 BCHE (0.43) GUSBBCHE
SCHEMBL293917 0.81 GLB1 (0.38) GNAO1GNAI3GNAI1BCHE
SCHEMBL16508848 0.81 GBA1 (0.42) GNAO1GNAI3GNAI1GUSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2204394-B1 PROCESS FOR PRODUCTION OF POLYESTER-CONTAINING FLEXIBLE POLYURETHANE FOAM, AND CATALYST COMPOSITION FOR USE IN THE PROCESS TOSOH CORP (JP) 2017-07-12 EP disclosed
US-8980965-B2 Method for producing polyester type flexible polyurethane foam, and catalyst composition to be used therefor TOSOH CORPORATION (JP) 2015-03-17 US disclosed
US-20100256249-A1 METHOD FOR PRODUCING POLYESTER TYPE FLEXIBLE POLYURETHANE FOAM, AND CATALYST COMPOSITION TO BE USED THEREFOR TOSOH CORPORATION (JP) 2010-10-07 US disclosed
EP-2204394-A1 PROCESS FOR PRODUCTION OF POLYESTER-CONTAINING FLEXIBLE POLYURETHANE FOAM, AND CATALYST COMPOSITION FOR USE IN THE PROCESS Tosoh Corporation (JP) 2010-07-07 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 (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-20100256249-A1 METHOD FOR PRODUCING POLYESTER TYPE FLEXIBLE POLYURETHANE FOAM, AND CATALYST COMPOSITION TO BE USED THEREFOR OR51E2, CYP4F11, FFAR3 GNAO1 2915/4885GNAI3 3947/4885GNAI1 3506/4885

“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.