SCHEMBL427501

SCHEMBL427501

CC(O)(c1ccc(N)cc1)C(F)(F)F

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 15/20 0.54
KIF11 P52732 1/20 0.46
GCK P35557 1/20 0.45
GCKR Q14397 1/20 0.45
NR1H3 Q13133 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL20956389 1.00 HSD11B1 (0.54) HSD11B1KIF11GCKGCKRNR1H3
SCHEMBL19181908 1.00 HSD11B1 (0.54) HSD11B1KIF11GCKGCKRNR1H3
Hydrochloric Acid SCHEMBL20956393 0.98 HSD11B1 (0.53) HSD11B1KIF11GCKGCKRNR1H3
Hydrochloric Acid SCHEMBL20956392 0.98 HSD11B1 (0.53) HSD11B1KIF11GCKGCKRNR1H3
Hydrochloric Acid SCHEMBL19179710 0.98 HSD11B1 (0.53) HSD11B1KIF11GCKGCKRNR1H3
SCHEMBL10165226 0.88 HSD11B1 (0.59) HSD11B1NR1H3
SCHEMBL13917764 0.85 ALDH1A1 (0.48) HSD11B1KIF11NPC1ALDH1A1MAPT
SCHEMBL25753451 0.81 HSD11B1 (0.53) HSD11B1NR1H3
SCHEMBL15459955 0.81 HSD11B1 (0.53) HSD11B1NR1H3
SCHEMBL5530921 0.79 MLYCD (0.52) HSD11B1NR1H3ALDH1A1

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 85 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240216361-A1 ROR-GAMMA MODULATORS ESCALIER BIOSCIENCES B V (US) 2024-07-04 US disclosed
US-20230277527-A1 ROR-GAMMA MODULATORS ESCALIER BIOSCIENCES B.V. 2023-09-07 US disclosed
US-20230096641-A1 HPK1 ANTAGONISTS AND USES THEREOF NIMBUS DISCOVERY, INC. 2023-03-30 US disclosed
US-11084784-B2 ROR-gamma modulators and uses thereof Piramal Enterprises Limited (IN) 2021-08-10 US disclosed
US-20210238198-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-08-05 US disclosed
EP-3210969-B1 KCNQ2-5 CHANNEL ACTIVATOR ONO PHARMACEUTICAL CO (JP) 2021-04-28 EP disclosed
US-10968236-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2021-04-06 US disclosed
US-10752624-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2020-08-25 US disclosed
CN-107108485-B KCNQ 2-5 channel activator 小野药品工业株式会社 2020-06-12 CN disclosed
US-10676438-B2 KCNQ2-5 channel activator ONO PHARMACEUTICAL CO., LTD. (JP) 2020-06-09 US disclosed
EP-1756096-B1 INDOLYL DERIVATIVES AS LIVER-X-RECEPTOR MODULATORS HOFFMANN LA ROCHE (CH) 2009-08-12 EP disclosed
EP-1917233-B1 ANILINOHEXAFLUOROISOPROPANOL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2008-12-17 EP disclosed
EP-1907357-A1 ANILINE SULFONAMIDE DERIVATIVES AND THEIR USES Amgen Inc. (US) 2008-04-09 EP disclosed
US-20070037862-A1 inhibitors of polo-like kinases; (4,4-Dimethyl-4,5-dihydro-oxazol-2-yl)-[3-ethyl-4-oxo-5-[1-[3-(2-pyrrolidin-1-yl-ethyl)-phenylamino]-meth-(E/Z)-ylidene]-thiazolidin-(2-(E or Z))-ylidene]-acetonitrile; cancer, auto-immune diseases, cardiovascular diseases BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-02-15 US disclosed
US-20070037862-A1 inhibitors of polo-like kinases; (4,4-Dimethyl-4,5-dihydro-oxazol-2-yl)-[3-ethyl-4-oxo-5-[1-[3-(2-pyrrolidin-1-yl-ethyl)-phenylamino]-meth-(E/Z)-ylidene]-thiazolidin-(2-(E or Z))-ylidene]-acetonitrile; cancer, auto-immune diseases, cardiovascular diseases BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-02-15 US disclosed
WO-2007013929-A1 ANILINE SULFONAMIDE DERIVATIVES AND THEIR USES AMGEN INC. (US) 2007-02-01 WO disclosed
WO-2007013929-A1 ANILINE SULFONAMIDE DERIVATIVES AND THEIR USES AMGEN INC. (US) 2007-02-01 WO disclosed
US-20070021502-A1 Aniline sulfonamide derivatives and their uses AMGEN INC. 2007-01-25 US disclosed
US-20070021502-A1 Aniline sulfonamide derivatives and their uses AMGEN INC. 2007-01-25 US disclosed
US-20070021502-A1 Aniline sulfonamide derivatives and their uses AMGEN INC. 2007-01-25 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 (10 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-20070037862-A1 inhibitors of polo-like kinases; (4,4-Dimethyl-4,5-dihydro-oxazol-2-yl)-[3-ethyl-4-oxo-5-[1-[3-(2-pyrrolidin-1-yl-ethyl)-phenylamino]-meth-(E/Z)-ylidene]-thiazolidin-(2-(E or Z))-ylidene]-acetonitrile; cancer, auto-immune diseases, cardiovascular diseases PLK2, PLK4, PDXK HSD11B1 3134/4885KIF11 2817/4885GCK 338/4885
US-20210238198-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 HSD11B1 3406/4885KIF11 1876/4885GCK 1721/4885
US-10968236-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 HSD11B1 3406/4885KIF11 1876/4885GCK 1721/4885
US-20230277527-A1 ROR-GAMMA MODULATORS RORB, RORC, RORA HSD11B1 87/4885KIF11 3808/4885GCK 4037/4885
US-20240216361-A1 ROR-GAMMA MODULATORS RORB, RORC, RORA HSD11B1 87/4885KIF11 3808/4885GCK 4037/4885
US-11084784-B2 ROR-gamma modulators and uses thereof RORB, RORA, RORC HSD11B1 17/4885KIF11 2802/4885GCK 4597/4885
US-20070021502-A1 Aniline sulfonamide derivatives and their uses ARSA, SULT2A1, SULT1A1 HSD11B1 680/4885KIF11 4011/4885GCK 1515/4885
US-20230096641-A1 HPK1 ANTAGONISTS AND USES THEREOF PDXK, HIPK1, PCK1 HSD11B1 762/4885KIF11 2128/4885GCK 50/4885
US-10676438-B2 KCNQ2-5 channel activator KCNQ5, KCNQ2, KCNQ1 HSD11B1 4314/4885KIF11 2061/4885GCK 972/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK HSD11B1 3523/4885KIF11 1709/4885GCK 951/4885

“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.