SCHEMBL18848893

SCHEMBL18848893

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

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 9/20 0.40
▸ FEN1 P39748 8/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ CYP11B2 P19099 5/20 0.38
▸ CYP11B1 P15538 4/20 0.38
▸ CYP3A4 P08684 1/20 0.37
▸ CYP3A5 P20815 1/20 0.37
▸ NPC1 O15118 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ GPR119 Q8TDV5 1/20 0.35
▸ SYK P43405 1/20 0.34

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
SCHEMBL18842706 0.85 CYP11B2 (0.40) ALOX5APFEN1CYP11B2CYP11B1NPC1
SCHEMBL7815438 0.78 ALDH1A1 (0.41) CYP3A4CYP3A5
SCHEMBL18848895 0.77 CYP1A2 (0.43) CYP1A2RAB9A
SCHEMBL14062416 0.77 ALOX5AP (0.41) ALOX5APFEN1CYP11B2CYP11B1NPC1
SCHEMBL10331375 0.72 CYP1A2 (0.46) ALOX5APCYP1A2CYP3A4CYP3A5TP53
SCHEMBL12896105 0.70 CYP11B1 (0.53) CYP1A2CYP11B2CYP11B1CYP3A4NPC1
SCHEMBL12896123 0.70 MAPK8 (0.44) FEN1CYP1A2CYP3A4
SCHEMBL26426730 0.70 KDM4E (0.47) CYP1A2CYP11B2CYP11B1RAB9A
SCHEMBL7807878 0.69 POLB (0.42) CYP3A4CYP3A5
SCHEMBL15889335 0.68 PIM1 (0.44) FEN1CYP11B2CYP11B1

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 ALOX5AP 1031/4885FEN1 4883/4885CYP1A2 1113/4885

“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.

Send feedback