SCHEMBL23589334

SCHEMBL23589334

COCC(=O)N1Cc2ccc(C3(C(=O)O)CC3)cc2C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ HSD17B10 Q99714 4/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ CYP2D6 P10635 7/20 0.40
▸ CYP3A4 P08684 8/20 0.39
▸ USP2 O75604 5/20 0.39
▸ CYP2C19 P33261 6/20 0.39
▸ MAPK1 P28482 3/20 0.39
▸ TP53 P04637 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ TSHR P16473 3/20 0.38
▸ HPGD P15428 2/20 0.38
▸ NAMPT P43490 1/20 0.38
▸ CYP2C9 P11712 4/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ TET3 O43151 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ FBXL19 Q6PCT2 1/20 0.38
▸ CXXC5 Q7LFL8 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
SCHEMBL20424926 0.89 NAMPT (0.42) CYP1A2ALDH1A1HSD17B10NPSR1CYP2D6
SCHEMBL20424513 0.81 NOTUM (0.50) HSD17B10NPSR1CYP2D6CYP3A4CYP2C19
SCHEMBL20436339 0.76 DPP8 (0.50) TSHRHPGDNAMPTSMN1; SMN2KMT2A
SCHEMBL20424518 0.75 DPP8 (0.51) ALDH1A1NPSR1HPGDNAMPTKMT2A
SCHEMBL20424593 0.73 HDAC1 (0.46) CYP2D6CYP3A4CYP2C19CYP2C9KMT2A
SCHEMBL23589294 0.72 NAMPT (0.46) NAMPT
SCHEMBL20424511 0.71 NOTUM (0.49) HSD17B10NPSR1KMT2A
SCHEMBL1465052 0.68 ALDH1A1 (0.52) CYP1A2ALDH1A1CYP2D6CYP3A4CYP2C19
SCHEMBL1465608 0.66 TLR7 (0.49) HSD17B10CYP2D6CYP3A4CYP2C19CYP2C9
SCHEMBL30083322 0.65 APP (0.42) CYP2D6CYP3A4CYP2C19CYP2C9APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3573960-B1 N-{[2-(PIPERIDIN-1-YL)PHENYL](PHENYL)METHYL}-2-(3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXAZIN-7-YL)ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ROR-GAMMA MODULATORS FOR TREATING AUTOIMMUNE DISEASES GENFIT (FR) 2023-08-16 — — EP disclosed
EP-3573960-B1 N-{[2-(PIPERIDIN-1-YL)PHENYL](PHENYL)METHYL}-2-(3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXAZIN-7-YL)ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ROR-GAMMA MODULATORS FOR TREATING AUTOIMMUNE DISEASES GENFIT (FR) 2023-08-16 — — EP disclosed
US-11052092-B2 N-{[2-(piperidin-1-yl)phenyl](phenyl)methyl}-2-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)acetamide derivatives and related compounds as ROR-gamma modulators for treating autoimmune diseases GENFIT (FR) 2021-07-06 — — US disclosed
US-11052092-B2 N-{[2-(piperidin-1-yl)phenyl](phenyl)methyl}-2-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)acetamide derivatives and related compounds as ROR-gamma modulators for treating autoimmune diseases GENFIT (FR) 2021-07-06 — — 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-11052092-B2 N-{[2-(piperidin-1-yl)phenyl](phenyl)methyl}-2-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)acetamide derivatives and related compounds as ROR-gamma modulators for treating autoimmune diseases RORA, RORC, RORB CYP1A2 137/4885ALDH1A1 118/4885HSD17B10 2237/4885

“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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