SCHEMBL4982155

SCHEMBL4982155

CCS(=O)(=O)NCC(N)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 5/20 0.65
GRIA4 P48058 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KCNA5 P22460 1/20 0.40
PTGES2 Q9H7Z7 1/20 0.40
PSIP1 O75475 1/20 0.40
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
NR3C2 P08235 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
SCHEMBL4984120 0.88 GBA1 (0.59) GBA1GRIA4MEN1KMT2AKCNA5
SCHEMBL4984422 0.85 GBA1 (0.56) GBA1GRIA4KCNA5MAPTHPGD
SCHEMBL4985141 0.84 GBA1 (0.67) GBA1GRIA4
SCHEMBL4986251 0.79 GBA1 (1.00) GBA1MEN1KMT2ATP53MAPT
SCHEMBL10216799 0.78 PNMT (0.44) GBA1MEN1KMT2ATP53MAPT
SCHEMBL10217202 0.77 ADRB2 (0.40) GBA1GRIA4MEN1KMT2APSIP1
Hydrochloric Acid SCHEMBL3446039 0.77 PNMT (0.43) GBA1MEN1KMT2ATP53MAPT
SCHEMBL4986451 0.76 GBA1 (0.79) GBA1MEN1KMT2ATP53MAPT
Hydrochloric Acid SCHEMBL19244881 0.76 BLM (0.40) GBA1GRIA4MEN1KMT2APSIP1
SCHEMBL12879312 0.76 GBA1 (0.79) GBA1MEN1KMT2ATP53MAPT

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
US-7393958-B2 Triamide-substituted heterobicyclic compounds PFIZER, INC. (US) 2008-07-01 US disclosed
US-7368573-B2 Triamide-substituted heterobicyclic compounds PFIZER INC. (US) 2008-05-06 US disclosed
US-20070093525-A1 Triamide-substituted heterobicyclic compounds PFIZER INC 2007-04-26 US disclosed
US-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS BERTINATO PETER 2006-10-05 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 (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-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS APOB, MTPN, CTRB1 GBA1 426/4885GRIA4 4068/4885MEN1 1637/4885
US-20070093525-A1 Triamide-substituted heterobicyclic compounds APOB, MTPN, CTRB1 GBA1 426/4885GRIA4 4068/4885MEN1 1637/4885

“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.