SCHEMBL4936837

SCHEMBL4936837

FC(F)(F)c1ccc(Cl)c(-c2ccc(N3CCC4(CC3)CCN(C3CCC3)CC4)nn2)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.43
CNR2 P34972 8/20 0.43
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SCD O00767 6/20 0.40
TP53 P04637 1/20 0.38
KDM1A O60341 1/20 0.38
FFAR4 Q5NUL3 1/20 0.37
SMO Q99835 1/20 0.35

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
SCHEMBL4130310 0.87 CNR2 (0.58) HRH3CNR2SCD
SCHEMBL14387372 0.86 HRH3 (0.41) HRH3CNR2NPC1MAPTRAB9A
SCHEMBL4292748 0.83 SCD (0.50) HRH3CNR2NPC1MAPTRAB9A
SCHEMBL4143600 0.83 CNR2 (0.47) HRH3CNR2NPC1MAPTRAB9A
SCHEMBL4125466 0.82 OPRM1 (0.43) CNR2NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL4294013 0.82 CNR2 (0.56) HRH3CNR2
SCHEMBL4928039 0.82 CNR2 (0.60) HRH3CNR2NPC1MAPTRAB9A
SCHEMBL4135808 0.81 CNR2 (0.46) HRH3CNR2MAPTSMN1; SMN2SCD
SCHEMBL4288868 0.80 CNR2 (0.58) CNR2NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL4935984 0.79 CNR2 (0.38) HRH3CNR2MAPTSCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080247964-A1 SUBSTITUTED AZASPIRO DERIVATIVES NEUROGEN CORPORATION 2008-10-09 US claimed
US-20080247964-A1 SUBSTITUTED AZASPIRO DERIVATIVES NEUROGEN CORPORATION 2008-10-09 US disclosed
US-20080247964-A1 SUBSTITUTED AZASPIRO DERIVATIVES NEUROGEN CORPORATION 2008-10-09 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-20080247964-A1 SUBSTITUTED AZASPIRO DERIVATIVES HRH3, HRH4, HRH1 HRH3 1/4885CNR2 75/4885NPC1 2854/4885

“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.