SCHEMBL4740498

SCHEMBL4740498

O=c1cc(O)nc(C2CCCCC2)n1Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 9/20 0.41
ABCB11 O95342 1/20 0.41
PPARG P37231 1/20 0.41
SRC P12931 1/20 0.41
PRKACA P17612 1/20 0.41
PRKACG P22612 1/20 0.41
PRKACB P22694 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
POLB P06746 1/20 0.41
PDE5A O76074 2/20 0.39
MTHFD2 P13995 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSP90B1 P14625 1/20 0.38
TRAP1 Q12931 1/20 0.38
SOS1 Q07889 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
SCHEMBL4741309 0.86 KMT2A (0.39) SMN1; SMN2POLB
SCHEMBL4740381 0.83 MDM2 (0.47)
SCHEMBL4741265 0.83 NPC1 (0.50) SMN1; SMN2POLB
SCHEMBL4740407 0.83 NPC1 (0.50) SMN1; SMN2POLB
SCHEMBL4739114 0.81 NPC1 (0.51) SRCSMN1; SMN2
SCHEMBL4739117 0.81 ALDH1A1 (0.47) CCR2POLBCYP1A2CYP3A4CYP2C9
SCHEMBL4738041 0.74 EGLN3 (0.49) PPARGSMN1; SMN2
SCHEMBL4741836 0.71 KMT2A (0.44)
SCHEMBL4741289 0.71 LMNA (0.43)
SCHEMBL4740112 0.70 APLNR (0.53) POLB

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
WO-2008089051-A1 N-SUBSTITUTED GLYCINE DERIVATIVES: PROLYL HYDROXYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-07-24 WO disclosed
US-20080171756-A1 N-Substituted Glycine Derivatives: Prolyl Hydroxylase Inhibitors SMITHKLINE BEECHAM CORPORATION 2008-07-17 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-20080171756-A1 N-Substituted Glycine Derivatives: Prolyl Hydroxylase Inhibitors HIF1AN, EGLN2, EGLN3 CCR2 3761/4885ABCB11 2047/4885PPARG 1880/4885

“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.