SCHEMBL20424764

SCHEMBL20424764

COc1ccc(C(N)c2ccc(C)o2)c(N2CCCCCC2)c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.39
▸ MAPT P10636 4/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ CSF1R P07333 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ GAA P10253 2/20 0.36
▸ HTR3E A5X5Y0 1/20 0.36
▸ HTR3B O95264 1/20 0.36
▸ HTR3A P46098 1/20 0.36
▸ HTR3D Q70Z44 1/20 0.36
▸ HTR3C Q8WXA8 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ TPH1 P17752 1/20 0.35
▸ P4HB P07237 1/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ PRKDC P78527 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ TP53 P04637 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
SCHEMBL20424558 1.00 KMT2A (0.39) KMT2AMAPTALDH1A1LMNACSF1R
SCHEMBL23589253 0.89 PRKDC (0.46) KMT2AMAPTALDH1A1HSD17B10GAA
Hydrochloric Acid SCHEMBL20424423 0.88 PRKDC (0.45) KMT2AMAPTALDH1A1HSD17B10GAA
SCHEMBL32659964 0.87 ALDH1A1 (0.36) KMT2AMAPTALDH1A1HSD17B10GAA
Hydrochloric Acid SCHEMBL20424810 0.86 ALDH1A1 (0.36) KMT2AMAPTALDH1A1HSD17B10GAA
SCHEMBL17872095 0.85 MAPT (0.36) KMT2AMAPTALDH1A1LMNAGAA
SCHEMBL23683804 0.83 FFAR1 (0.35) KMT2AMAPTALDH1A1GAAHTR3E
SCHEMBL23683833 0.83 PKM (0.35) KMT2AMAPTALDH1A1LMNAHSD17B10
SCHEMBL23589298 0.83 MAPT (0.35) KMT2AMAPTALDH1A1LMNAGAA
Hydrochloric Acid SCHEMBL20424703 0.82 FFAR1 (0.35) KMT2AMAPTALDH1A1GAAHTR3E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3573961-B1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2023-10-25 — — EP disclosed
EP-3573961-B1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2023-10-25 — — 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
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-10987351-B2 RORgamma modulators and uses thereof GENFIT (FR) 2021-04-27 — — US disclosed
WO-2018138362-A1 N-{[2-(PIPERIDIN-1-YL)PHENYL](PHENYL)METHYL}-2-(3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXA ZIN-7-YL)ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ROR-GAMMA MODULATORS FOR TREATING AUTOIMMUNE DISEASES GENFIT (FR) 2018-08-02 — — WO disclosed
WO-2018138359-A1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2018-08-02 — — WO disclosed
WO-2018138354-A1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2018-08-02 — — WO 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 (2 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 KMT2A 635/4885MAPT 3199/4885ALDH1A1 118/4885
US-10987351-B2 RORgamma modulators and uses thereof RORB, RORC, RORA KMT2A 2471/4885MAPT 4111/4885ALDH1A1 761/4885

“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