SCHEMBL14904407

SCHEMBL14904407

CC(=O)NC1CC(F)(F)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.42
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 2/20 0.39
ALOX15 P16050 1/20 0.38
EPHX2 P34913 1/20 0.37
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
TACR1 P25103 1/20 0.34
TACR3 P29371 1/20 0.34
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
GRM6 O15303 2/20 0.33
GRM2 Q14416 2/20 0.33
GRM3 Q14832 2/20 0.33
CA12 O43570 2/20 0.33
TLR4 O00206 1/20 0.33
CA9 Q16790 1/20 0.33
GRM8 O00222 1/20 0.33

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
Hydrochloric Acid SCHEMBL30777466 0.98 ATM (0.41) ATMALDH1A1KDM4EALOX15EPHX2
SCHEMBL14970367 0.83 ALOX15 (0.47) ATMALDH1A1KDM4EALOX15EPHX2
SCHEMBL26172551 0.82 ATM (0.38) ATMALDH1A1KDM4EALOX15EPHX2
SCHEMBL24939292 0.82 EPHX2 (0.35) EPHX2APLNR
SCHEMBL31072096 0.80 CHRNB2 (0.36) ATMALDH1A1KDM4EALOX15EPHX2
SCHEMBL27186331 0.79 GAA (0.35) KDM4EEPHX2APLNR
SCHEMBL15129467 0.78 APLNR (0.33) EPHX2APLNR
SCHEMBL19198696 0.77 IDO1 (0.38) ATMEPHX2MTNR1AMTNR1B
SCHEMBL12437203 0.77 EPHX2 (0.59) ATMALDH1A1KDM4EALOX15EPHX2
SCHEMBL31493448 0.77 ATM (0.39) ATMALDH1A1KDM4EALOX15MTNR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240383863-A1 PREPARATION METHOD FOR PYRIMIDINE-2-AMINE INSTITUTE FOR BASIC SCIENCE (KR) 2024-11-21 US disclosed
EP-4408530-A1 BENZIMIDAZOLES AS MODULATORS OF IL-17 Janssen Pharmaceutica NV (BE) 2024-08-07 EP disclosed
EP-3356345-B1 HETEROARYL DERIVATIVES AS SEPIAPTERIN REDUCTASE INHIBITORS MAX PLANCK GESELLSCHAFT (DE) 2023-11-08 EP disclosed
CN-114507244-B Imidazo thiazole compound, pharmaceutical composition and application thereof 广州市恒诺康医药科技有限公司 2023-10-27 CN disclosed
WO-2023072974-A1 TRICYCLIC HETEROCYCLES MERCK PATENT GMBH (DE) 2023-05-04 WO disclosed
WO-2023049888-A1 BENZIMIDAZOLES AS MODULATORS OF IL-17 JANSSEN PHARMACEUTICA NV (BE) 2023-03-30 WO disclosed
WO-2023043292-A1 PREPARATION METHOD FOR PYRIMIDINE-2-AMINE 기초과학연구원 2023-03-23 WO disclosed
WO-2023025109-A1 TOLL-LIKE RECEPTOR INHIBITOR AND PREPARATION AND APPLICATION THEREOF 上海维申医药有限公司 2023-03-02 WO disclosed
CN-114907341-A Pyridopyrimidinone derivatives, and preparation method and application thereof 武汉人福创新药物研发中心有限公司 2022-08-16 CN disclosed
WO-2022166974-A1 PYRIDOPYRIMIDINONE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF 武汉人福创新药物研发中心有限公司 2022-08-11 WO disclosed
US-20150284384-A1 RING-FUSED HETEROCYCLIC COMPOUND KYOWA KIRIN CO., LTD. (JP) 2015-10-08 US disclosed
EP-2881394-A1 CONDENSED RING HETEROCYCLIC COMPOUND Kyowa Hakko Kirin Co., Ltd. (JP) 2015-06-10 EP disclosed
US-9018200-B2 Substituted piperidinyl compounds useful as GPR119 agonists MERCK SHARP & DOHME CORP. (US) 2015-04-28 US disclosed
US-9000186-B2 Ring-fused heterocyclic derivative KYOWA HAKKO KIRIN CO., LTD. (JP) 2015-04-07 US disclosed
US-9000186-B2 Ring-fused heterocyclic derivative KYOWA HAKKO KIRIN CO., LTD. (JP) 2015-04-07 US disclosed
US-20140296202-A1 SUBSTITUTED PIPERIDINYL COMPOUNDS USEFUL AS GPR119 AGONISTS MERCK SHARP & DOHME CORP. (US) 2014-10-02 US disclosed
US-20140058103-A1 Inhibitors of PI3K-Delta and Methods of Their Use and Manufacture EXELIXIS, INC. (US) 2014-02-27 US disclosed
US-20140038941-A1 RING-FUSED HETEROCYCLIC DERIVATIVE KYOWA HAKKO KIRIN CO., LTD. (JP) 2014-02-06 US disclosed
US-20140038941-A1 RING-FUSED HETEROCYCLIC DERIVATIVE KYOWA HAKKO KIRIN CO., LTD. (JP) 2014-02-06 US disclosed
WO-2013062838-A1 SUBSTITUTED PIPERIDINYL COMPOUNDS USEFUL AS GPR119 AGONISTS MERCK SHARP & DOHME CORP. (US) 2013-05-02 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 (5 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-20240383863-A1 PREPARATION METHOD FOR PYRIMIDINE-2-AMINE NUDT1, UMPS, DPYD ATM 1142/4885ALDH1A1 2073/4885KDM4E 2802/4885
US-20140296202-A1 SUBSTITUTED PIPERIDINYL COMPOUNDS USEFUL AS GPR119 AGONISTS GPR119, GPR27, GPR139 ATM 4317/4885ALDH1A1 1340/4885KDM4E 3884/4885
US-20140058103-A1 Inhibitors of PI3K-Delta and Methods of Their Use and Manufacture PIK3CD, PIK3CA, PIK3R5 ATM 975/4885ALDH1A1 3321/4885KDM4E 2378/4885
US-20140038941-A1 RING-FUSED HETEROCYCLIC DERIVATIVE CACNA1E, SLC8A1, CALCR ATM 4632/4885ALDH1A1 3112/4885KDM4E 3779/4885
US-20150284384-A1 RING-FUSED HETEROCYCLIC COMPOUND TRPV1, TRPV2, TRPV3 ATM 4786/4885ALDH1A1 4202/4885KDM4E 3471/4885

“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.