SCHEMBL1055385

SCHEMBL1055385

C[Si](C)(C)OCCn1nnc(-c2ccc(OCc3ccccc3)c(F)c2)n1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.53
MAPT P10636 2/20 0.53
TSHR P16473 1/20 0.53
RAB9A P51151 1/20 0.53
MAOB P27338 3/20 0.48
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41
GRM2 Q14416 1/20 0.41
LMNA P02545 2/20 0.40
ERN1 O75460 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL1060735 0.83 NPC1 (0.54) NPC1MAPTTSHRRAB9AMAOB
SCHEMBL1058756 0.82 NPC1 (0.52) NPC1MAPTTSHRRAB9AMAOB
SCHEMBL1060421 0.80 ALDH1A1 (0.44) NPC1MAPTTSHRRAB9AUSP2
SCHEMBL1053714 0.78 TRPV1 (0.47) NPC1MAPTTSHRRAB9ALMNA
SCHEMBL1059430 0.72 ALDH1A1 (0.51) NPC1MAPTTSHRRAB9ATP53
SCHEMBL7793991 0.70 XDH (0.53) ERN1
SCHEMBL29254959 0.70 LTA4H (0.45) NPC1MAPTTSHRRAB9AMAOB
SCHEMBL1055134 0.69 MRGPRX4 (0.56) MAPTLMNAALDH1A1
SCHEMBL31086482 0.69 MRGPRX4 (0.56) MAPTLMNAALDH1A1
SCHEMBL8993289 0.69 ERN1 (0.57) MAPTGRM2ERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2643310-A1 4- (5-CYANO-PYRAZOL-1-YL) -PIPERIDINE DERIVATIVES AS GPR 119 MODULATORS Pfizer Inc (US) 2013-10-02 EP disclosed
WO-2012069948-A1 4- (5-CYANO-PYRAZOL-1-YL) -PIPERIDINE DERIVATIVES AS GPR 119 MODULATORS PFIZER INC. (US) 2012-05-31 WO disclosed
EP-2438051-A1 L- ( PIPERIDIN-4-YL) -PYRAZOLE DERIVATIVES AS GPR 119 MODULATORS Pfizer Inc. (US) 2012-04-11 EP disclosed
US-20110020460-A1 GPR 119 MODULATORS PFIZER INC. 2011-01-27 US disclosed
WO-2010140092-A1 L- ( PIPERIDIN-4-YL) -PYRAZOLE DERIVATIVES AS GPR 119 MODULATORS PFIZER INC. (US) 2010-12-09 WO 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-20110020460-A1 GPR 119 MODULATORS GPR119, GPR65, GPR88 NPC1 626/4885MAPT 3575/4885TSHR 504/4885

“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.