SCHEMBL4283594

SCHEMBL4283594

CCC(=O)N1CCC(c2ccc(F)cc2)(N2CCN(C)CC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
HTT P42858 1/20 0.47
OPRM1 P35372 3/20 0.46
EPHX2 P34913 1/20 0.42
HSD11B1 P28845 2/20 0.41
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
RORC P51449 1/20 0.39
LMNA P02545 2/20 0.39
KDM1A O60341 1/20 0.39
MAOB P27338 1/20 0.39
GAA P10253 1/20 0.39
SLC6A9 P48067 1/20 0.39
CYP2D6 P10635 1/20 0.38
NPC1 O15118 1/20 0.38
TP53 P04637 1/20 0.38
RAB9A P51151 1/20 0.38
TSHR P16473 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
SCHEMBL4280485 0.87 OPRM1 (0.57) OPRM1EPHX2LMNA
SCHEMBL4273032 0.85 MAPK1 (0.46) SMN1; SMN2HTTOPRM1EPHX2LMNA
SCHEMBL4120887 0.74 SLC6A9 (0.39) SMN1; SMN2OPRM1LMNASLC6A9CYP2D6
SCHEMBL4276599 0.70 CYP2C9 (0.49) SMN1; SMN2OPRM1CYP2D6TSHR
SCHEMBL802314 0.68 CYP1A2 (0.54) SMN1; SMN2HTTDRD3LMNAGAA
SCHEMBL18390065 0.68 HSD11B1 (0.64) SMN1; SMN2HTTOPRM1EPHX2HSD11B1
SCHEMBL4280380 0.68 OPRM1 (0.47) SMN1; SMN2OPRM1LMNAKDM1AMAOB
SCHEMBL25870846 0.67 CYP1A2 (0.44) OPRM1EPHX2CYP2D6TSHR
SCHEMBL4548020 0.67 POLB (0.69) SMN1; SMN2HTTHSD11B1
SCHEMBL7838280 0.67 BLM (0.71) SMN1; SMN2HTTEPHX2HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090253669-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-08 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-20090253669-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 SMN1; SMN2 824/4885HTT 2146/4885OPRM1 2798/4885

“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.