SCHEMBL10244858

SCHEMBL10244858

CC(=O)c1ccc(C#N)cc1F

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.52
MAPT P10636 3/20 0.48
GAA P10253 1/20 0.48
GPR27 Q9NS67 1/20 0.47
ALDH1A1 P00352 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
LMNA P02545 1/20 0.46
PKM P14618 1/20 0.45
MAP2K1 Q02750 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
THRB P10828 2/20 0.43
TP53 P04637 1/20 0.43
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
MAOB P27338 1/20 0.42
TRPA1 O75762 1/20 0.41
S1PR3 Q99500 1/20 0.41

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
SCHEMBL7213897 0.85 GRM5 (0.46) KMT2AMEN1MAPTGAAGPR27
SCHEMBL29286624 0.83 MEN1 (0.50) KMT2AMEN1MAPTGAAGPR27
SCHEMBL389029 0.83 MAP2K1 (0.55) KMT2AMEN1MAPTGAAGPR27
SCHEMBL409948 0.82 MEN1 (0.50) KMT2AMEN1MAPTGAAGPR27
SCHEMBL3176877 0.81 DGAT1 (0.55) KMT2AMEN1MAPTGAAGPR27
SCHEMBL646582 0.81 KMT2A (0.49) KMT2AMEN1MAPTGAAGPR27
SCHEMBL1417563 0.81 KMT2A (0.56) KMT2AMEN1MAPTGAAGPR27
SCHEMBL30032704 0.81 KMT2A (0.46) KMT2AMEN1MAPTGAAGPR27
SCHEMBL12780519 0.81 TRPA1 (0.47) KMT2AMEN1MAPTGAAGPR27
SCHEMBL3361866 0.79 LRRK2 (0.48) KMT2AMEN1MAPTALDH1A1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111517985-B Preparation method of 4- [ (1R) -1-amino-2-hydroxyethyl ] -3-fluoro-benzonitrile 济南百润医药科技有限公司 2023-05-12 CN claimed
CN-111517985-A Preparation method of 4- [ (1R) -1-amino-2-hydroxyethyl ] -3-fluoro-benzonitrile 苏州明锐医药科技有限公司 2020-08-11 CN claimed
US-12509431-B2 1,4-dihydroquinazolinone compounds and uses thereof EDGEWISE THERAPEUTICS, INC. (US) 2025-12-30 US disclosed
US-20250361213-A1 1,4-DIHYDROQUINAZOLINONE COMPOUNDS AND USES THEREOF EDGEWISE THERAPEUTICS INC (US) 2025-11-27 US disclosed
EP-4594307-A1 1,4-DIHYDROQUINAZOLINONE COMPOUNDS AND USES THEREOF EDGEWISE THERAPEUTICS, INC. (US) 2025-08-06 EP disclosed
US-20250230137-A1 P300/CBP HAT INHIBITORS CONSTELLATION PHARMACEUTICALS INC (US) 2025-07-17 US disclosed
CN-115335374-B GLP-1R modulating compounds 吉利德科学公司 2025-05-27 CN disclosed
US-20250154111-A1 1,4-DIHYDROQUINAZOLINONE COMPOUNDS AND USES THEREOF EDGEWISE THERAPEUTICS, INC. 2025-05-15 US disclosed
US-20250099431-A1 GLP-1R MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2025-03-27 US disclosed
EP-4523751-A2 GLP-1R MODULATING COMPOUNDS Gilead Sciences, Inc. (US) 2025-03-19 EP disclosed
US-20250042883-A1 GLP-1R AGONISTS AND USES THEREOF QILU REGOR THERAPEUTICS INC. (CN) 2025-02-06 US disclosed
EP-2576557-B1 NOVEL ANTIFUNGAL 5,6-DIHYDRO-4-[(DIFLUORETHYL)PHENYL]-4H-PYRROLO[1,2-A][1,4]BENZODIAZEPAN AND 4-(DIFLUORETHYL)PHENYL-6H-PYRROLO[1,2-A][1,4]BENZODIAZEPIN DERIVATIVES. JANSSEN PHARMACEUTICA NV (BE) 2014-05-21 EP disclosed
US-20130085136-A1 NOVEL ANTIFUNGAL 5,6-DIHYDRO-4-[(DIFLUOROETHYL)PHENYL]-4H-PYRROLO[1,2-a][1,4]BENZODIAZEPINE AND 4-(DIFLUOROETHYL)PHENYL-6H-PYRROLO[1,2-a][1,4]BENZODIAZEPINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2013-04-04 US disclosed
US-20130085136-A1 NOVEL ANTIFUNGAL 5,6-DIHYDRO-4-[(DIFLUOROETHYL)PHENYL]-4H-PYRROLO[1,2-a][1,4]BENZODIAZEPINE AND 4-(DIFLUOROETHYL)PHENYL-6H-PYRROLO[1,2-a][1,4]BENZODIAZEPINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2013-04-04 US disclosed
US-8299055-B2 8-substituted isoquinoline derivative and the use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2012-10-30 US disclosed
US-8119678-B2 Compounds, compositions and methods CYTOKINETICS, INCORPORATED (US) 2012-02-21 US disclosed
WO-2011154298-A1 NOVEL ANTIFUNGAL 5,6-DIHYDRO-4-[(DIFLUOROETHYL)PHENYL]-4H-PYRROLO[1,2-a][1,4]BENZODIAZEPINE AND 4-(DIFLUOROETHYL)PHENYL-6H-PYRROLO[1,2-a][1,4]BENZODIAZEPINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2011-12-15 WO disclosed
US-20110230550-A1 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INC. 2011-09-22 US disclosed
US-20100261701-A1 8-Substituted isoquinoline derivative and the use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2010-10-14 US disclosed
WO-2010038465-A1 8-SUBSTITUTED ISOQUINOLINE DERIVATIVE AND USE THEREOF 旭化成ファーマ株式会社 (JP) 2010-04-08 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 (9 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-20250099431-A1 GLP-1R MODULATING COMPOUNDS GLP1R, GIPR, GPR119 KMT2A 3755/4885MEN1 2141/4885MAPT 3347/4885
US-12509431-B2 1,4-dihydroquinazolinone compounds and uses thereof TNNT2, TNNI3, TNNC1 KMT2A 3822/4885MEN1 3410/4885MAPT 4455/4885
US-20110230550-A1 COMPOUNDS, COMPOSITIONS AND METHODS ALPP, PCNA, MKI67 KMT2A 2046/4885MEN1 1461/4885MAPT 2834/4885
US-20250154111-A1 1,4-DIHYDROQUINAZOLINONE COMPOUNDS AND USES THEREOF TNNI3, TNNT2, SDHA KMT2A 3454/4885MEN1 2996/4885MAPT 3072/4885
US-20100261701-A1 8-Substituted isoquinoline derivative and the use thereof RELA, NFKBIA, NFKB2 KMT2A 637/4885MEN1 2532/4885MAPT 3817/4885
US-20130085136-A1 NOVEL ANTIFUNGAL 5,6-DIHYDRO-4-[(DIFLUOROETHYL)PHENYL]-4H-PYRROLO[1,2-a][1,4]BENZODIAZEPINE AND 4-(DIFLUOROETHYL)PHENYL-6H-PYRROLO[1,2-a][1,4]BENZODIAZEPINE DERIVATIVES GABBR1, CYP2D6, GABBR2 KMT2A 1739/4885MEN1 3762/4885MAPT 2360/4885
US-20250042883-A1 GLP-1R AGONISTS AND USES THEREOF GLP1R, GPR119, GIPR KMT2A 3912/4885MEN1 2574/4885MAPT 4018/4885
US-20250361213-A1 1,4-DIHYDROQUINAZOLINONE COMPOUNDS AND USES THEREOF TNNI3, TNNT2, SDHA KMT2A 3454/4885MEN1 2996/4885MAPT 3072/4885
US-20250230137-A1 P300/CBP HAT INHIBITORS EP300, HDAC1, KAT2A KMT2A 161/4885MEN1 2358/4885MAPT 887/4885

“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.