SCHEMBL7999568

SCHEMBL7999568

CS(=O)(=O)c1ccc(C=O)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
HTR2A P28223 1/20 0.40
KCNH2 Q12809 1/20 0.40
ALDH1A1 P00352 6/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KCNJ1 P48048 1/20 0.38
PIK3CD O00329 1/20 0.37
PIP5K1C O60331 1/20 0.37
PIK3CB P42338 1/20 0.37
PI4KA P42356 1/20 0.37
PIK3CG P48736 1/20 0.37
PI4KB Q9UBF8 1/20 0.37
CYP2A6 P11509 3/20 0.37
ALDH3A1 P30838 1/20 0.35
ALDH1A3 P47895 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 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
SCHEMBL20574663 0.88 PIK3CD (0.40) KDM4EHTR2AKCNH2ALDH1A1L3MBTL1
SCHEMBL30445256 0.88 PIK3CD (0.40) KDM4EHTR2AKCNH2ALDH1A1L3MBTL1
SCHEMBL27827435 0.86 HTR2A (0.39) KDM4EHTR2AKCNH2ALDH1A1PIK3CD
SCHEMBL3466929 0.84 HTR2A (0.40) HTR2AKCNH2PIK3CDPIP5K1CPIK3CB
SCHEMBL7557765 0.82 HTR2A (0.39) HTR2AKCNH2ALDH1A1PIK3CDPIP5K1C
SCHEMBL3466553 0.82 HTR2A (0.36) HTR2AKCNH2PIK3CDPIP5K1CPIK3CB
SCHEMBL20927152 0.79 CYP2A6 (0.38) KDM4EHTR2AKCNH2ALDH1A1L3MBTL1
SCHEMBL3466368 0.78 PIK3CD (0.37) KDM4EHTR2AKCNH2ALDH1A1PIK3CD
SCHEMBL3465757 0.78 PIK3CD (0.37) HTR2AKCNH2ALDH1A1PIK3CDPIP5K1C
SCHEMBL7981856 0.76 HTR2A (0.41) KDM4EHTR2AKCNH2ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12583855-B2 RET selective inhibitor, preparation method therefor and use thereof Shouyao Holdings (beijing) Co., Ltd. (CN) 2026-03-24 US disclosed
CN-117865952-A RET selective inhibitor and preparation method and application thereof 首药控股(北京)股份有限公司 2024-04-12 CN disclosed
CN-114072404-B RET selective inhibitor and preparation method and application thereof 首药控股(北京)股份有限公司 2023-09-15 CN disclosed
WO-2023154344-A1 2-METHYL-4',5'-DIHYDROSPIRO[PIPERIDINE-4,7'-THIENO[2,3-C]PYRAN] DERIVATIVES AS INHIBITORS OF APOL1 AND METHODS OF USING SAME VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-08-17 WO disclosed
US-11524958-B2 Tricyclic compound as CRTH2 inhibitor CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-12-13 US disclosed
US-20220289740-A1 RET SELECTIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF Shouyao Holdings (beijing) Co., Ltd. (CN) 2022-09-15 US disclosed
EP-3998265-A1 RET SELECTIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF Shouyao Holdings (Beijing) Co., Ltd. (CN) 2022-05-18 EP disclosed
CN-109153642-B Indole and azaindole halogenated allylamine derivative inhibitors of lysyl oxidase and uses thereof 法玛西斯有限公司 2022-05-17 CN disclosed
US-20210403466-A1 TRICYCLIC COMPUND AS CRTH2 INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2021-12-30 US disclosed
US-10717734-B2 Indole and azaindole haloallylamine derivative inhibitors of lysyl oxidases and uses thereof PHARMAXIS LTD. (AU) 2020-07-21 US disclosed
US-6022967-A 1-NITRO-2-CARBOXYVINYL- OR 1-NITRO-2-(DIMETHYLAMINO)VINYL-SUBSTITUTED IMIDAZOLIDINES OR TETRAHYDROPYRIMIDINES NIHON BAYER AGROCHEM K.K. (JP) 2000-02-08 US disclosed
US-5750704-A INSECTICIDES NIHON BAYER AGROCHEM K.K. (JP) 1998-05-12 US disclosed
US-5580889-A Insecticidal nitromethyl or niteoimino-heteromethyl-heterocyclics NIHON BAYER AGROCHEM K.K. (JP) 1996-12-03 US disclosed
US-5461167-A 2-chloro-5-chloromethyl thiazole; insecticide NIHON BAYER AGROCHEM K.K. (JP) 1995-10-24 US disclosed
US-5428032-A Insecticides NIHON BAYER AGROCHEM K.K. (JP) 1995-06-27 US disclosed
US-5298507-A Insecticides NIHON BAYER AGROCHEM K.K. (JP) 1994-03-29 US disclosed
US-5204360-A Insecticides NIHON BAYER AGROCHEM K.K. (JP) 1993-04-20 US disclosed
US-4845106-A INSECTICIDES NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1989-07-04 US disclosed
US-4742060-A 2-(NITROIMINO)- OR 2-(NITROMETHYLENE)-IMIDAZOLIDINES AS INSECTICIDES NIHON TOKUSHU NOYAKU SEIZO K. K. (JP) 1988-05-03 US disclosed
EP-0192060-A1 Heterocyclic compounds NIHON BAYER AGROCHEM K.K. (JP) 1986-08-27 EP 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-12583855-B2 RET selective inhibitor, preparation method therefor and use thereof RET, ROR1, TMPRSS11D KDM4E 2606/4885HTR2A 3236/4885KCNH2 4440/4885
US-20220289740-A1 RET SELECTIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF RET, REN, ROR1 KDM4E 3095/4885HTR2A 3924/4885KCNH2 4799/4885
US-10717734-B2 Indole and azaindole haloallylamine derivative inhibitors of lysyl oxidases and uses thereof IDO1, IDO2, INMT KDM4E 359/4885HTR2A 433/4885KCNH2 2398/4885
US-20210403466-A1 TRICYCLIC COMPUND AS CRTH2 INHIBITOR NR3C2, CRHR2, CRHR1 KDM4E 4769/4885HTR2A 604/4885KCNH2 2013/4885
US-11524958-B2 Tricyclic compound as CRTH2 inhibitor NR1H2, NR3C2, NR1H4 KDM4E 4751/4885HTR2A 772/4885KCNH2 1295/4885

“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.