SCHEMBL423349

SCHEMBL423349

CC(C)c1cc(F)ccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.45
HTR2A P28223 2/20 0.45
SLC6A4 P31645 2/20 0.45
PSEN1 P49768 5/20 0.43
PSEN2 P49810 5/20 0.43
APH1B Q8WW43 5/20 0.43
NCSTN Q92542 5/20 0.43
APH1A Q96BI3 5/20 0.43
PSENEN Q9NZ42 5/20 0.43
JAK2 O60674 4/20 0.40
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
LMNA P02545 2/20 0.38
JAK1 P23458 1/20 0.38
TYK2 P29597 1/20 0.38
JAK3 P52333 1/20 0.38
RECQL P46063 1/20 0.37
HRH4 Q9H3N8 1/20 0.36
P2RX7 Q99572 2/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL420958 0.84 LMNA (0.42) KCNH2HTR2ASLC6A4PSEN1PSEN2
SCHEMBL17553255 0.82 KCNH2 (0.43) KCNH2HTR2ASLC6A4PSEN1PSEN2
SCHEMBL31521500 0.82 LMNA (0.50) KCNH2HTR2ASLC6A4PSEN1PSEN2
SCHEMBL30142930 0.82 PDE2A (0.47) KCNH2HTR2ASLC6A4PSEN1PSEN2
SCHEMBL19115614 0.82 KCNH2 (0.43) KCNH2HTR2ASLC6A4PSEN1PSEN2
SCHEMBL23489650 0.82 PDE2A (0.47) KCNH2HTR2ASLC6A4PSEN1PSEN2
SCHEMBL16957963 0.82 KCNH2 (0.43) KCNH2HTR2ASLC6A4PSEN1PSEN2
SCHEMBL17216071 0.82 PDE2A (0.47) KCNH2HTR2ASLC6A4PSEN1PSEN2
SCHEMBL2588946 0.82 PDE2A (0.47) KCNH2HTR2ASLC6A4PSEN1PSEN2
SCHEMBL29167805 0.82 LMNA (0.50) KCNH2HTR2ASLC6A4PSEN1PSEN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024103400-A1 POLYCYCLIC COMPOUND AS GPR75 ACTIVATOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF 水木未来(北京)科技有限公司 2024-05-23 WO disclosed
US-11912668-B2 GCN2 and perk kinase inhibitors and methods of use thereof DECIPHERA PHARMACEUTICALS, LLC (US) 2024-02-27 US disclosed
EP-4273146-A1 TRICYCLIC COMPOUND AND USE THEREOF Nanjing Zaiming Pharmaceutical Co., Ltd. (CN) 2023-11-08 EP disclosed
US-20230353959-A1 PI3K-ALPHA INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. 2023-11-02 US disclosed
US-20230322799-A1 ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 UNITED STATES GOVERNMENT 2023-10-12 US disclosed
US-20230322747-A1 OXADIAZOLE HDAC6 INHIBITORS AND USES THEREOF EIKONIZO THERAPEUTICS, INC. (US) 2023-10-12 US disclosed
US-20230322747-A1 OXADIAZOLE HDAC6 INHIBITORS AND USES THEREOF EIKONIZO THERAPEUTICS, INC. (US) 2023-10-12 US disclosed
WO-2023196601-A1 OXADIAZOLE HDAC6 INHIBITORS AND USES THEREOF EIKONIZO THERAPEUTICS, INC. (US) 2023-10-12 WO disclosed
US-20230322799-A1 ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 UNITED STATES GOVERNMENT 2023-10-12 US disclosed
US-20230265110-A1 Proteasome Inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-08-24 US disclosed
WO-2009020448-A1 PROTEASOME INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-02-12 WO disclosed
US-20090042836-A1 e.g. 1-({[(2,3-difluorobenzoyl)amino]acetyl}amino)-3-methylbutyl]boronic acid; anticarcinogenic, antiproliferative agent MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-02-12 US disclosed
US-7442830-B1 Proteasome inhibitors MILLENIUM PHARMACEUTICALS, INC. (US) 2008-10-28 US disclosed
US-20070161685-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-07-12 US disclosed
US-20070161685-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-07-12 US disclosed
US-20070135631-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-06-14 US disclosed
US-20070105890-A1 Novel condensed imidazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD 2007-05-10 US disclosed
US-20070105890-A1 Novel condensed imidazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD 2007-05-10 US disclosed
US-20070082908-A1 Bicycle pyrazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-12 US disclosed
US-20070082908-A1 Bicycle pyrazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-12 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 (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-20230322747-A1 OXADIAZOLE HDAC6 INHIBITORS AND USES THEREOF HDAC6, HDAC1, HDAC11 KCNH2 4791/4885HTR2A 3529/4885SLC6A4 4135/4885
US-20070161685-A1 HETEROCYCLIC CETP INHIBITORS CETP, CES1, NPC1 KCNH2 2789/4885HTR2A 2793/4885SLC6A4 4513/4885
US-20230322799-A1 ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 CHRM4, CHRM3, CHRM2 KCNH2 249/4885HTR2A 323/4885SLC6A4 457/4885
US-20070105890-A1 Novel condensed imidazole derivative DPP4, DPP7, DPP3 KCNH2 604/4885HTR2A 1167/4885SLC6A4 145/4885
US-20070135631-A1 HETEROCYCLIC CETP INHIBITORS CETP, CES1, NPC1 KCNH2 2789/4885HTR2A 2793/4885SLC6A4 4513/4885
US-20230265110-A1 Proteasome Inhibitors PSMB5, PSMG3, PSMB1 KCNH2 4243/4885HTR2A 4505/4885SLC6A4 4724/4885
US-20070082908-A1 Bicycle pyrazole derivative DPP4, DPP7, DPP3 KCNH2 806/4885HTR2A 1714/4885SLC6A4 419/4885
US-11912668-B2 GCN2 and perk kinase inhibitors and methods of use thereof EIF2AK4, GCN1, MAPKAPK2 KCNH2 3737/4885HTR2A 3263/4885SLC6A4 3957/4885
US-20090042836-A1 e.g. 1-({[(2,3-difluorobenzoyl)amino]acetyl}amino)-3-methylbutyl]boronic acid; anticarcinogenic, antiproliferative agent PSMB1, PSMB11, PSMB5 KCNH2 3697/4885HTR2A 4568/4885SLC6A4 4752/4885

“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.