SCHEMBL4130116

SCHEMBL4130116

CCOC(=O)c1ccc(CCCCO)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4A11 Q02928 6/20 0.71
CYP4F2 P78329 5/20 0.71
CA12 O43570 2/20 0.56
CA1 P00915 2/20 0.56
CA2 P00918 2/20 0.56
CA7 P43166 2/20 0.56
CA9 Q16790 2/20 0.56
CA14 Q9ULX7 2/20 0.56
ESR1 P03372 1/20 0.56
ESR2 Q92731 1/20 0.56
LMNA P02545 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
MAOA P21397 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
HPGD P15428 4/20 0.49
HTT P42858 3/20 0.49
KCNJ1 P48048 1/20 0.48
KCNH2 Q12809 1/20 0.48
NPC1 O15118 1/20 0.48

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
SCHEMBL3049924 0.95 CYP4A11 (0.70) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL1701986 0.90 CYP4A11 (0.58) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL15122388 0.90 CYP4A11 (0.58) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL570964 0.88 RARB (0.58) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL6389650 0.88 CYP4A11 (0.64) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL6394479 0.87 CA12 (0.56) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL6900234 0.87 THRA (0.59) CA12CA1CA2CA7CA9
SCHEMBL6123675 0.87 THRA (0.59) CA12CA1CA2CA7CA9
SCHEMBL12040863 0.87 THRA (0.59) CA12CA1CA2CA7CA9
SCHEMBL6899814 0.87 THRA (0.59) CA12CA1CA2CA7CA9

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240209011-A1 HETEROAROMATIC PHOSPHONIUM SALTS FOR TREATING CANCER FLORATEK PHARMA S A (CH) 2024-06-27 US disclosed
US-20240209011-A1 HETEROAROMATIC PHOSPHONIUM SALTS FOR TREATING CANCER FLORATEK PHARMA S A (CH) 2024-06-27 US disclosed
EP-4284517-A1 HETEROAROMATIC PHOSPHONIUM SALTS FOR TREATING CANCER Floratek Pharma SA (CH) 2023-12-06 EP disclosed
US-20220411448-A1 CHROMENE-4-ONE DERIVATIVES AS BRAIN-DERIVED NEUROTROPHIC FACTOR (BDNF) MIMETICS Floratek Pharma SA (CH) 2022-12-29 US disclosed
US-20220411448-A1 CHROMENE-4-ONE DERIVATIVES AS BRAIN-DERIVED NEUROTROPHIC FACTOR (BDNF) MIMETICS Floratek Pharma SA (CH) 2022-12-29 US disclosed
WO-2022162029-A1 HETEROAROMATIC PHOSPHONIUM SALTS FOR TREATING CANCER FLORATEK PHARMA AG (CH) 2022-08-04 WO disclosed
EP-4031538-A1 CHROMENE-4-ONE DERIVATIVES AS BRAIN-DERIVED NEUROTROPHIC FACTOR (BDNF) MIMETICS Floratek Pharma AG (CH) 2022-07-27 EP disclosed
WO-2021053205-A1 CHROMENE-4-ONE DERIVATIVES AS BRAIN-DERIVED NEUROTROPHIC FACTOR (BDNF) MIMETICS FLORATEK PHARMA AG (CH) 2021-03-25 WO disclosed
WO-2021053205-A1 CHROMENE-4-ONE DERIVATIVES AS BRAIN-DERIVED NEUROTROPHIC FACTOR (BDNF) MIMETICS FLORATEK PHARMA AG (CH) 2021-03-25 WO disclosed
US-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2009-05-14 US disclosed
US-5093370-A Useful prior to insertion of tracheotomy tube or discission TOBISHI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 1992-03-03 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 (3 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-20240209011-A1 HETEROAROMATIC PHOSPHONIUM SALTS FOR TREATING CANCER PIK3CA, TP53, CDK4 CYP4A11 232/4885CYP4F2 552/4885CA12 1053/4885
US-20220411448-A1 CHROMENE-4-ONE DERIVATIVES AS BRAIN-DERIVED NEUROTROPHIC FACTOR (BDNF) MIMETICS BDNF, NTRK2, NGF CYP4A11 316/4885CYP4F2 242/4885CA12 3749/4885
US-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AGTR1, AGTR2, AHR CYP4A11 122/4885CYP4F2 113/4885CA12 3863/4885

“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.