SCHEMBL780298

SCHEMBL780298

CCC(C)(C)c1ccc(F)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
MAPT P10636 2/20 0.48
MAPK1 P28482 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
CASP3 P42574 1/20 0.41
ATM Q13315 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
CNR2 P34972 2/20 0.40
KDM4E B2RXH2 1/20 0.39
MAOB P27338 3/20 0.39
HRH3 Q9Y5N1 3/20 0.39
CYP17A1 P05093 1/20 0.39
MEN1 O00255 1/20 0.38
XBP1 P17861 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL24555477 0.91 NPC1 (0.43) NPC1RAB9AMAPTMAPK1SMN1; SMN2
SCHEMBL779443 0.87 NPC1 (0.58) NPC1RAB9AMAPTMAPK1SMN1; SMN2
SCHEMBL19002400 0.84 LTA4H (0.47) NPC1RAB9AMAPTMAPK1SMN1; SMN2
SCHEMBL21791678 0.82 NPC1 (0.50) NPC1RAB9AMAPTMAPK1SMN1; SMN2
SCHEMBL19232109 0.81 CNR2 (0.42) NPC1RAB9AMAPTMAPK1SMN1; SMN2
SCHEMBL15294399 0.80 NPC1 (0.48) NPC1RAB9AMAPTMAPK1SMN1; SMN2
SCHEMBL14625003 0.80 ESR1 (0.45) NPC1RAB9AMAPTMAPK1SMN1; SMN2
SCHEMBL5552840 0.79 NPC1 (0.52) NPC1RAB9AMAPTMAPK1SMN1; SMN2
SCHEMBL3625528 0.79 NPC1 (0.52) NPC1RAB9AMAPTMAPK1SMN1; SMN2
SCHEMBL3292125 0.79 NPC1 (0.52) NPC1RAB9AMAPTMAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12100809-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2024-09-24 US disclosed
WO-2024150676-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION 富士フイルム株式会社 2024-07-18 WO disclosed
US-20230384677-A1 ONIUM SALT COMPOUND, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-11-30 US disclosed
US-20230364097-A1 TREATMENT OF CANCERS USING PI3 KINASE ISOFORM MODULATORS INFINITY PHARMACEUTICALS, INC. (US) 2023-11-16 US disclosed
US-20230303544-A1 LMO2 PROTEIN INHIBITORS UNIV OF OXFORD (GB) 2023-09-28 US disclosed
US-20230255950-A1 3-(Hydroxy)-Pyridin-4(1H)-One Compounds and Methods of Making and Using the Same GEORGIA TECH RESEARCH CORPORATION 2023-08-17 US disclosed
US-20230226040-A1 COMBINATION THERAPY COMPRISING AN FGFR INHIBITOR AND A KRAS INHIBITOR INCYTE CORPORATION 2023-07-20 US disclosed
US-RE49582-E1 Therapeutic compounds and compositions AGIOS PHARMACEUTICALS, INC. (US) 2023-07-18 US disclosed
US-20230150972-A1 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS XENON PHARMACEUTICALS INC. (CA) 2023-05-18 US disclosed
US-20230145305-A1 COMPOUNDS USEFUL AS KINASE INHIBITORS FOCHON BIOSCIENCES, LTD. (CN) 2023-05-11 US disclosed
US-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed
US-7615316-B2 Nonaqueous electrolytic solution and lithium secondary batteries UBE INDUSTRIES, LTD. (JP) 2009-11-10 US disclosed
EP-2012386-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY Mitsubishi Chemical Corporation (JP) 2009-01-07 EP disclosed
EP-1361622-B1 NONAQUEOUS ELECTROLYTIC SOLUTION AND LITHIUM SECONDARY BATTERIES UBE INDUSTRIES (JP) 2008-06-04 EP disclosed
US-20080050658-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND LITHIUM SECONDARY BATTERIES UBE INDUSTRIES, LTD. (JP) 2008-02-28 US disclosed
US-7294436-B2 Nonaqueous electrolytic solution and lithium secondary batteries UBE INDUSTRIES, LTD. (JP) 2007-11-13 US disclosed
CN-1249840-C Nonaqueous electrolyte solution and lithium secondary battery UBE INDUSTRIES (JP) 2006-04-05 CN disclosed
US-20040121239-A1 Nonaqueous electrolytic solution and lithium secondary batteries UBE INDUSTRIES, LTD. (JP) 2004-06-24 US disclosed
CN-1498438-A Nonaqueous electrolyte solution and lithium secondary battery ��˲���ʽ���� 2004-05-19 CN disclosed
EP-1361622-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND LITHIUM SECONDARY BATTERIES Ube Industries, Ltd. (JP) 2003-11-12 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 (7 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-20230255950-A1 3-(Hydroxy)-Pyridin-4(1H)-One Compounds and Methods of Making and Using the Same KDM1B, KDM3A, KDM1A NPC1 4132/4885RAB9A 3914/4885MAPT 3227/4885
US-20230303544-A1 LMO2 PROTEIN INHIBITORS LMNB2, LMNB1, TPX2 NPC1 3032/4885RAB9A 3250/4885MAPT 2968/4885
US-20230145305-A1 COMPOUNDS USEFUL AS KINASE INHIBITORS BTK, ABL1, LCK NPC1 3164/4885RAB9A 1562/4885MAPT 3429/4885
US-20230384677-A1 ONIUM SALT COMPOUND, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS INSR, INSRR, SLC6A5 NPC1 3749/4885RAB9A 3054/4885MAPT 714/4885
US-20230226040-A1 COMBINATION THERAPY COMPRISING AN FGFR INHIBITOR AND A KRAS INHIBITOR KRAS, FGFR2, FGFR3 NPC1 4429/4885RAB9A 237/4885MAPT 4526/4885
US-20230364097-A1 TREATMENT OF CANCERS USING PI3 KINASE ISOFORM MODULATORS PIK3CA, MCL1, PIK3CB NPC1 3237/4885RAB9A 1648/4885MAPT 4584/4885
US-20230150972-A1 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS SCN1B, SCN1A, SCN2B NPC1 2158/4885RAB9A 628/4885MAPT 302/4885

“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.