SCHEMBL9952219

SCHEMBL9952219

COC(=O)C(N)Cc1cc(O)cc(F)c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
HSP90AB1 P08238 1/20 0.40
SLC7A5 Q01650 4/20 0.40
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
LNPEP Q9UIQ6 4/20 0.36
ERAP2 Q6P179 3/20 0.36
ERAP1 Q9NZ08 1/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 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
SCHEMBL12804024 1.00 ALDH1A1 (0.43) ALDH1A1HSP90AB1SLC7A5ESR1ESR2
SCHEMBL30765033 1.00 ALDH1A1 (0.43) ALDH1A1HSP90AB1SLC7A5ESR1ESR2
SCHEMBL3967937 0.91 ALDH1A1 (0.47) ALDH1A1SLC7A5CYP4F2CYP4A11
SCHEMBL2659518 0.91 ALDH1A1 (0.47) ALDH1A1SLC7A5CYP4F2CYP4A11
Hydrochloric Acid SCHEMBL1202263 0.89 ALDH1A1 (0.49) ALDH1A1SLC7A5CYP4F2CYP4A11
Hydrochloric Acid SCHEMBL4248195 0.89 ALDH1A1 (0.49) ALDH1A1SLC7A5CYP4F2CYP4A11
SCHEMBL15933890 0.84 ALDH1A1 (0.42) ALDH1A1SLC7A5CYP4F2CYP4A11
SCHEMBL22944374 0.84 ALDH1A1 (0.42) ALDH1A1SLC7A5CYP4F2CYP4A11
Hydrochloric Acid SCHEMBL15873938 0.82 ALDH1A1 (0.44) ALDH1A1SLC7A5CYP4F2CYP4A11
Hydrochloric Acid SCHEMBL15873940 0.82 ALDH1A1 (0.44) ALDH1A1SLC7A5CYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107090476-B Sanglifehrin derivatives and process for preparing the same 爱博利瓦有限公司 2021-09-24 CN disclosed
EP-3427737-A1 SANGLIFEHRIN DERIVATIVES AND METHODS FOR THEIR PRODUCTION NeuroVive Pharmaceutical AB (SE) 2019-01-16 EP disclosed
EP-2654753-B1 SANGLIFEHRIN DERIVATIVES AND METHODS FOR THEIR PRODUCTION NEUROVIVE PHARMACEUTICAL AB (SE) 2018-10-31 EP disclosed
EP-2770977-B1 NOVEL DOSAGE FORM NEUROVIVE PHARMACEUTICAL AB (SE) 2017-07-12 EP disclosed
EP-2770977-B1 NOVEL DOSAGE FORM NEUROVIVE PHARMACEUTICAL AB (SE) 2017-07-12 EP disclosed
US-9504728-B2 Dosage form NEUROVIVE PHARMACEUTICAL AB (SE) 2016-11-29 US disclosed
US-9504728-B2 Dosage form NEUROVIVE PHARMACEUTICAL AB (SE) 2016-11-29 US disclosed
US-9504728-B2 Dosage form NEUROVIVE PHARMACEUTICAL AB (SE) 2016-11-29 US disclosed
US-9271977-B2 Sanglifehrin derivatives and methods for their production NEUROVIVE PHARMACEUTICAL AB (SE) 2016-03-01 US disclosed
US-9271977-B2 Sanglifehrin derivatives and methods for their production NEUROVIVE PHARMACEUTICAL AB (SE) 2016-03-01 US disclosed
WO-2013061052-A1 NOVEL DOSAGE FORM BIOTICA TECHNOLOGY LIMITED (GB) 2013-05-02 WO disclosed
US-20120251581-A1 Novel Compound and Methods for its Production Abliva Ab (SE) 2012-10-04 US disclosed
US-20120251581-A1 Novel Compound and Methods for its Production Abliva Ab (SE) 2012-10-04 US disclosed
US-20120251581-A1 Novel Compound and Methods for its Production Abliva Ab (SE) 2012-10-04 US disclosed
WO-2012131371-A1 MACROCYCLIC COMPOUND AND METHODS FOR ITS PRODUCTION BIOTICA TECHNOLOGY LIMITED (GB) 2012-10-04 WO disclosed
WO-2012131377-A1 MACROCYCLIC COMPOUNDS AND METHODS FOR THEIR PRODUCTION BIOTICA TECHNOLOGY LIMITED (GB) 2012-10-04 WO disclosed
WO-2012131371-A1 MACROCYCLIC COMPOUND AND METHODS FOR ITS PRODUCTION BIOTICA TECHNOLOGY LIMITED (GB) 2012-10-04 WO disclosed
WO-2012131377-A1 MACROCYCLIC COMPOUNDS AND METHODS FOR THEIR PRODUCTION BIOTICA TECHNOLOGY LIMITED (GB) 2012-10-04 WO disclosed
WO-2012085553-A1 SANGLIFEHRIN DERIVATIVES AND METHODS FOR THEIR PRODUCTION BIOTICA TECHNOLOGY LIMITED (GB) 2012-06-28 WO disclosed
WO-2012085553-A1 SANGLIFEHRIN DERIVATIVES AND METHODS FOR THEIR PRODUCTION BIOTICA TECHNOLOGY LIMITED (GB) 2012-06-28 WO 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 (1 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-20120251581-A1 Novel Compound and Methods for its Production EIF2AK2, HAVCR2, CYP51A1 ALDH1A1 1700/4885HSP90AB1 1595/4885SLC7A5 2824/4885

“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.