SCHEMBL7670889

SCHEMBL7670889

O=C(S)[C@@H]1CCCN1C(=O)NC1CCCCC1

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.71
SMN1; SMN2 Q16637 1/20 0.71
POLB P06746 2/20 0.58
TSHR P16473 4/20 0.57
NPSR1 Q6W5P4 1/20 0.57
ALDH1A1 P00352 3/20 0.54
HTT P42858 1/20 0.51
TDP1 Q9NUW8 2/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL7837668 1.00 KDM4E (0.71) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL5950255 0.85 KDM4E (0.73) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL6534174 0.85 KDM4E (0.73) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL7837671 0.82 KDM4E (0.69) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL7670891 0.82 KDM4E (0.69) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL9977731 0.76 KDM4E (0.61) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL18051877 0.76 KDM4E (0.61) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL5736424 0.76 KDM4E (0.66) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL7677217 0.75 KDM4E (0.41) KDM4ESMN1; SMN2KMT2A
SCHEMBL7680329 0.75 LMNA (0.44) KDM4ESMN1; SMN2POLBNPSR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020049199-A1 N-linked carbamates and ureas of heterocyclic thioesters GLIAMED, INC. 2002-04-25 US claimed
EP-0959882-A4 N-LINKED UREAS AND CARBAMATES OF HETEROCYCLIC THIOESTERS HAMILTON GREGORY S (US) 2001-12-05 EP claimed
EP-0959882-A1 N-LINKED UREAS AND CARBAMATES OF HETEROCYCLIC THIOESTERS GUILFORD PHARMACEUTICALS INC. (US) 1999-12-01 EP claimed
WO-1998029117-A1 N-LINKED UREAS AND CARBAMATES OF HETEROCYCLIC THIOESTERS GUILFORD PHARMACEUTICALS INC. (US) 1998-07-09 WO claimed
US-20020049199-A1 N-linked carbamates and ureas of heterocyclic thioesters GLIAMED, INC. 2002-04-25 US disclosed
US-6274607-B1 INHIBITORS OF PEPTIDYL-PROLYL ISOMERASE, OR ROTAMASE ENZYME ACTIVITY; DO NOT EXERT ANY IMMUNOSUPPRESSIVE ACTIVITY IN ADDITION TO THEIR NEUROTROPHIC ACTIVITY; BIOAVAILABILITY; POTENCY GPI NIL HOLDINGS, INC. 2001-08-14 US disclosed
US-5958949-A INHIBITORS OF THE ENZYME ACTIVITY ASSOCIATED WITH IMMUNOPHILIN PROTEINS, PARTICULARLY PEPTIDYL-PROLYL ISOMERASE, OR ROTAMASE, ENZYME ACTIVITY; TREATMENT OF NERVOUS SYSTEM DISORDERS GPI NIL HOLDINGS INC. (US) 1999-09-28 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-20020049199-A1 N-linked carbamates and ureas of heterocyclic thioesters FKBP8, FKBP1A, FKBP3 KDM4E 1326/4885SMN1; SMN2 3103/4885POLB 4554/4885

“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.