SCHEMBL3565835

SCHEMBL3565835

CCNc1ccc(CN2CCN(C(=O)O)[C@@](C)(C(C)(C)C)C2)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
TP53 P04637 2/20 0.41
POLB P06746 1/20 0.41
FAAH O00519 3/20 0.37
SIGMAR1 Q99720 1/20 0.37
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 1/20 0.37
KDM4E B2RXH2 3/20 0.36
HIF1A Q16665 1/20 0.35
EPAS1 Q99814 1/20 0.35
NPY2R P49146 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 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
SCHEMBL377425 0.88 RAB9A (0.40) RAB9ANPC1TP53POLBFAAH
SCHEMBL377693 0.88 RAB9A (0.40) RAB9ANPC1TP53POLBFAAH
SCHEMBL377823 0.83 LMNA (0.44) RAB9ANPC1SIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL377467 0.83 LMNA (0.44) RAB9ANPC1SIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL1704763 0.82 CYP4F2 (0.38) FAAHSIGMAR1ALDH1A1SMN1; SMN2LMNA
SCHEMBL377869 0.81 KDM4E (0.53) RAB9ANPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL377528 0.81 KDM4E (0.53) RAB9ANPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL1997046 0.77 MEN1 (0.48) RAB9ANPC1POLBALDH1A1SMN1; SMN2
SCHEMBL1996929 0.76 KDM4E (0.46) RAB9ANPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL1632683 0.75 KDM4E (0.48) POLBFAAHSIGMAR1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7700599-B2 G protein coupled receptor inhibitors (Gpr38) such as 6-[(4-fluorophenyl)oxy]-N-methyl-N-(4-{[(3S)-3-methyl-1-piperazinyl]methyl}phenyl)-3-pyridinecarboxamide for treatment of gastric stasis in an enterally fed patient GLAXO GROUP LIMITED (GB) 2010-04-20 US disclosed
US-20080027065-A1 G protein coupled receptor inhibitors (Gpr38) such as 6-[(4-fluorophenyl)oxy]-N-methyl-N-(4-{[(3S)-3-methyl-1-piperazinyl]methyl}phenyl)-3-pyridinecarboxamide for treatment of gastric stasis in an enterally fed patient GLAXO GROUP LIMITED (GB) 2008-01-31 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-20080027065-A1 G protein coupled receptor inhibitors (Gpr38) such as 6-[(4-fluorophenyl)oxy]-N-methyl-N-(4-{[(3S)-3-methyl-1-piperazinyl]methyl}phenyl)-3-pyridinecarboxamide for treatment of gastric stasis in an enterally fed patient GPR68, GPR88, GPR3 RAB9A 1337/4885NPC1 2662/4885TP53 4750/4885

“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.