SCHEMBL2855779

SCHEMBL2855779

CC(C)(C)OC(=O)N1CCn2c(C(F)(F)F)nc(Br)c2C1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.44
LIPG Q9Y5X9 1/20 0.40
HDAC4 P56524 1/20 0.39
ESR2 Q92731 1/20 0.38
DPP4 P27487 1/20 0.38
MAPT P10636 3/20 0.37
GPR119 Q8TDV5 1/20 0.36
CYP8B1 Q9UNU6 1/20 0.36
KCNH2 Q12809 1/20 0.36
USP2 O75604 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
POLB P06746 1/20 0.34
HTT P42858 1/20 0.34
ATM Q13315 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
SCHEMBL27779376 0.88 NR1H2 (0.36) NR1H2LIPGHDAC4ESR2DPP4
SCHEMBL27779222 0.86 NR1H2 (0.37) NR1H2LIPGHDAC4ESR2DPP4
SCHEMBL27779496 0.85 NR1H2 (0.37) NR1H2LIPGHDAC4ESR2DPP4
SCHEMBL13175269 0.85 NR1H2 (0.44) NR1H2LIPGHDAC4ESR2DPP4
SCHEMBL27800696 0.84 NR1H2 (0.36) NR1H2LIPGHDAC4DPP4MAPT
SCHEMBL2860794 0.84 DPP4 (0.53) NR1H2LIPGHDAC4ESR2DPP4
SCHEMBL2863171 0.84 DPP4 (0.41) NR1H2LIPGHDAC4ESR2DPP4
SCHEMBL2856421 0.84 LIPG (0.42) NR1H2LIPGHDAC4ESR2DPP4
SCHEMBL27800665 0.84 GRIA1 (0.41) NR1H2LIPGHDAC4KCNH2
SCHEMBL27779511 0.83 CYP8B1 (0.34) NR1H2LIPGHDAC4ESR2DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113474346-B Compositions for inhibiting ubiquitin-specific protease 1 福马治疗有限公司 2024-12-27 CN disclosed
US-20220073525-A1 COMPOSITIONS FOR INHIBITING UBIQUITIN SPECIFIC PROTEASE 1 FORMA THERAPEUTICS, INC. (US) 2022-03-10 US disclosed
EP-3902802-A1 COMPOSITIONS FOR INHIBITING UBIQUITIN SPECIFIC PROTEASE 1 Forma Therapeutics, Inc. (US) 2021-11-03 EP disclosed
WO-2020139988-A1 COMPOSITIONS FOR INHIBITING UBIQUITIN SPECIFIC PROTEASE 1 FORMA THERAPEUTICS, INC. (US) 2020-07-02 WO disclosed
WO-2020139988-A1 COMPOSITIONS FOR INHIBITING UBIQUITIN SPECIFIC PROTEASE 1 FORMA THERAPEUTICS, INC. (US) 2020-07-02 WO disclosed
US-9566277-B2 Methods of using phthalazinone ketone derivatives JIANGSU HANSOH PHARMACEUTICAL CO., LTD. (CN) 2017-02-14 US disclosed
US-9566277-B2 Methods of using phthalazinone ketone derivatives JIANGSU HANSOH PHARMACEUTICAL CO., LTD. (CN) 2017-02-14 US disclosed
US-9566277-B2 Methods of using phthalazinone ketone derivatives JIANGSU HANSOH PHARMACEUTICAL CO., LTD. (CN) 2017-02-14 US disclosed
US-20160151367-A1 METHODS OF USING PHTHALAZINONE KETONE DERIVATIVES JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2016-06-02 US disclosed
US-20160151367-A1 METHODS OF USING PHTHALAZINONE KETONE DERIVATIVES JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2016-06-02 US disclosed
US-20120220766-A1 TETRAHYDRO-IMIDAZO[1,5-alpha] PYRAZINE DERIVATIVES, PREPERATION PROCESS AND MEDICINAL USE THEREOF SHANGHAI HENGRUI PHARMACEUTICAL CO., LTD. (CN) 2012-08-30 US disclosed
US-20120220766-A1 TETRAHYDRO-IMIDAZO[1,5-alpha] PYRAZINE DERIVATIVES, PREPERATION PROCESS AND MEDICINAL USE THEREOF SHANGHAI HENGRUI PHARMACEUTICAL CO., LTD. (CN) 2012-08-30 US disclosed
US-8207161-B2 Tetrahydro-imidazo[1,5-α]pyrazine derivatives, preparation process and medicinal use thereof JIANGSU HENGRUI MEDICINE CO. LTD. (CN) 2012-06-26 US disclosed
US-8207161-B2 Tetrahydro-imidazo[1,5-α]pyrazine derivatives, preparation process and medicinal use thereof JIANGSU HENGRUI MEDICINE CO. LTD. (CN) 2012-06-26 US disclosed
US-8207161-B2 Tetrahydro-imidazo[1,5-α]pyrazine derivatives, preparation process and medicinal use thereof JIANGSU HENGRUI MEDICINE CO. LTD. (CN) 2012-06-26 US disclosed
US-20100273786-A1 TETRAHYDRO-IMIDAZ0[1,5-A]PYRAZINE DERIVATIVES, PREPARATION PROCESS AND MEDICINAL USE THEREOF JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2010-10-28 US disclosed
US-20100273786-A1 TETRAHYDRO-IMIDAZ0[1,5-A]PYRAZINE DERIVATIVES, PREPARATION PROCESS AND MEDICINAL USE THEREOF JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2010-10-28 US disclosed
US-20100273786-A1 TETRAHYDRO-IMIDAZ0[1,5-A]PYRAZINE DERIVATIVES, PREPARATION PROCESS AND MEDICINAL USE THEREOF JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2010-10-28 US disclosed
EP-2230241-A1 TETRAHYDRO-IMIDAZOÝ1,5-A¨PYRAZINE DERIVATIVES, PREPARATION METHODS AND MEDICAL USES THEREOF Jiangsu Hengrui Medicine Co., Ltd. (CN) 2010-09-22 EP disclosed
CN-101641361-A Tetrahydroimidazo [1, 5-a ] pyrazine derivative, preparation method and application thereof in medicine SHANGHAI HENGRUI PHARM CO LTD 2010-02-03 CN 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 (4 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-20120220766-A1 TETRAHYDRO-IMIDAZO[1,5-alpha] PYRAZINE DERIVATIVES, PREPERATION PROCESS AND MEDICINAL USE THEREOF DPP4, DPP3, DPP7 NR1H2 2937/4885LIPG 2955/4885HDAC4 758/4885
US-20160151367-A1 METHODS OF USING PHTHALAZINONE KETONE DERIVATIVES PARP1, PARP2, PARP3 NR1H2 2188/4885LIPG 2321/4885HDAC4 49/4885
US-20220073525-A1 COMPOSITIONS FOR INHIBITING UBIQUITIN SPECIFIC PROTEASE 1 USP1, USP2, USP3 NR1H2 3340/4885LIPG 1497/4885HDAC4 1254/4885
US-20100273786-A1 TETRAHYDRO-IMIDAZ0[1,5-A]PYRAZINE DERIVATIVES, PREPARATION PROCESS AND MEDICINAL USE THEREOF DPP4, DPP7, DPP3 NR1H2 3996/4885LIPG 2941/4885HDAC4 579/4885

“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.