SCHEMBL18842706

SCHEMBL18842706

CC(C)(C)Oc1ccc(-c2ccc(C(C)(C)C)c(F)c2)nc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 7/20 0.40
▸ CYP11B1 P15538 5/20 0.40
▸ NPC1 O15118 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ ALOX5AP P20292 3/20 0.36
▸ FEN1 P39748 2/20 0.36
▸ GPR119 Q8TDV5 1/20 0.36
▸ DGAT1 O75907 1/20 0.34
▸ RIPK1 Q13546 1/20 0.34
▸ KDM1A O60341 1/20 0.34
▸ CYP4F2 P78329 1/20 0.34
▸ CYP4A11 Q02928 1/20 0.34
▸ GRM2 Q14416 1/20 0.33

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
SCHEMBL18848893 0.85 ALOX5AP (0.40) CYP11B2CYP11B1NPC1TP53PKM
SCHEMBL14062416 0.81 ALOX5AP (0.41) CYP11B2CYP11B1NPC1TP53PKM
SCHEMBL18842717 0.75 CYP11B2 (0.39) CYP11B2CYP11B1ALOX5APFEN1DGAT1
SCHEMBL18842707 0.75 TDO2 (0.43) CYP11B2CYP11B1NPC1RAB9ASMN1; SMN2
SCHEMBL26426730 0.73 KDM4E (0.47) CYP11B2CYP11B1RAB9A
SCHEMBL17171957 0.71 ALOX5AP (0.38) CYP11B2CYP11B1ALOX5APFEN1
SCHEMBL18842708 0.71 ALOX5AP (0.58) NPC1RAB9AALOX5APFEN1DGAT1
SCHEMBL15889335 0.71 PIM1 (0.44) CYP11B2CYP11B1FEN1
SCHEMBL18842711 0.70 KIF11 (0.37) CYP11B2CYP11B1ALOX5APFEN1
SCHEMBL18848885 0.69 TNKS (0.44) CYP11B2CYP11B1NPC1TP53PKM

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-9776987-B2 Amide derivatives for GPR119 agonist CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2017-10-03 — — US disclosed
US-20170129875-A1 AMIDE DERIVATIVES FOR GPR119 AGONIST CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2017-05-11 — — 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-20170129875-A1 AMIDE DERIVATIVES FOR GPR119 AGONIST GPR119, FFAR2, GLP1R CYP11B2 830/4885CYP11B1 945/4885NPC1 896/4885

“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.

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