SCHEMBL7948592

SCHEMBL7948592

CCCCC(F)C(=O)OC

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.59
CA1 P00915 4/20 0.59
MAPT P10636 1/20 0.50
ZDHHC7 Q9NXF8 1/20 0.50
ABCB1 P08183 1/20 0.39
TSHR P16473 2/20 0.39
CYP3A4 P08684 1/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPK1 P28482 1/20 0.39
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
CES2 O00748 1/20 0.38
BIRC2 Q13490 1/20 0.37
ACHE P22303 2/20 0.37
ALDH1A1 P00352 1/20 0.37
EPHX1 P07099 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
SCHEMBL11311824 1.00 CA2 (0.59) CA2CA1MAPTZDHHC7ABCB1
SCHEMBL7948589 1.00 CA2 (0.59) CA2CA1MAPTZDHHC7ABCB1
SCHEMBL11537488 0.94 MAPT (0.59) CA2CA1MAPTZDHHC7ABCB1
SCHEMBL11864360 0.92 MAPT (0.62) CA2CA1MAPTZDHHC7ABCB1
SCHEMBL1667140 0.92 MAPT (0.62) CA2CA1MAPTZDHHC7ABCB1
SCHEMBL11534187 0.92 MAPT (0.62) CA2CA1MAPTZDHHC7ABCB1
SCHEMBL15939807 0.92 MAPT (0.62) CA2CA1MAPTZDHHC7ABCB1
SCHEMBL5749106 0.84 MAPT (0.52) CA2CA1MAPTZDHHC7TSHR
SCHEMBL7095852 0.83 CA1 (0.50) CA2CA1MAPTZDHHC7ABCB1
SCHEMBL7096850 0.83 MAPT (0.50) CA2CA1MAPTZDHHC7TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200190012-A1 C-HALOGEN BOND FORMATION THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2020-06-18 US claimed
US-20140227184-A1 C-HALOGEN BOND FORMATION THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2014-08-14 US claimed
CN-110800150-B Non-aqueous electrolyte and electrolytic solution containing electrolyte stabilizing material, secondary battery containing the same, and use thereof 株式会社村田制作所 2022-11-29 CN disclosed
CN-110800150-A Non-aqueous electrolyte and electrolytic solution containing electrolyte stabilizing material, secondary battery containing the same, and use thereof 株式会社村田制作所 2020-02-14 CN disclosed
US-6265440-B1 STOMACH ULCERS R-TECH UENO, LTD. (JP) 2001-07-24 US disclosed
US-5886034-A ANTIULCER AGENTS KABUSHIKI KAISHA UENO SEIYAKU KENKYUJO (JP) 1999-03-23 US disclosed
US-5770759-A 13,14-DIHYDRO-15-KETO-PGF'S; VASOPRESSORS R-TECH UENO, LTD. (JP) 1998-06-23 US disclosed
US-5591887-A 13,14-DIHYDRO-15-KETO-PGFS R-TECH UENO, LTD. (JP) 1997-01-07 US disclosed
US-5428062-A Side effect reduction K.K. UENO SEIYAKU OYO KENKYUJO (JP) 1995-06-27 US disclosed
US-5380709-A Prostaglandins E and anti ulcers containing same K.K. UENO SEIYAKU OYO KENKYUJO (JP) 1995-01-10 US disclosed
US-5284858-A Prostaglandins E and anti ulcers containing same KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1994-02-08 US disclosed
EP-0284180-A1 Prostaglandins E and anti ulcers containing same Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1988-09-28 EP disclosed
US-4256911-A TRIFLUOROMETHYL-CARBOXY ESTERS HOFFMANN-LA ROCHE INC. (US) 1981-03-17 US disclosed
US-4211724-A ENANTIOMORPHS, INTERMEDIATE AMIDES WITH ASSYMETRIC CARBON ATOM HOFFMAN-LA ROCHE INC. (US) 1980-07-08 US disclosed
US-4138577-A 11-Deoxy-cis-4,5-didehydro-ω-aryl-PGF compounds THE UPJOHN COMPANY (US) 1979-02-06 US disclosed
US-4138575-A 11-Deoxy-16-phenoxy-PGF compounds THE UPJOHN COMPANY (US) 1979-02-06 US disclosed
US-4138573-A 11-Deoxy-2,2-difluoro-ω-aryl-PGE compounds THE UPJOHN COMPANY (US) 1979-02-06 US disclosed
US-4138576-A 11-Deoxy-2,2-difluoro-ω-aryl-PGF compounds THE UPJOHN COMPANY (US) 1979-02-06 US disclosed
US-4126754-A 11-Deoxy-cis-4,5-didehydro-ω-aryl-PGE compounds THE UPJOHN COMPANY (US) 1978-11-21 US disclosed
US-3933889-A 4,5-Cis-didehydro-PGF1.sub.α analogs THE UPJOHN COMPANY (US) 1976-01-20 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 (2 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-20200190012-A1 C-HALOGEN BOND FORMATION CBR3, FOS, CBR1 CA2 1303/4885CA1 429/4885MAPT 4035/4885
US-20140227184-A1 C-HALOGEN BOND FORMATION CBR3, FOS, CBR1 CA2 1303/4885CA1 429/4885MAPT 4035/4885

“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.