SCHEMBL412063

SCHEMBL412063

CCC(O)Cn1ccnc1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGER Q15109 1/20 0.51
FDPS P14324 1/20 0.50
CYP19A1 P11511 1/20 0.47

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
SCHEMBL17934931 1.00 AGER (0.51) AGERFDPSCYP19A1
Hydrochloric Acid SCHEMBL411541 0.98 AGER (0.50) AGERFDPSCYP19A1
SCHEMBL10247560 0.87 AGER (0.62) AGERFDPSCYP19A1
Hydrochloric Acid SCHEMBL1775858 0.85 AGER (0.60) AGERFDPSCYP19A1
SCHEMBL6306204 0.82 TBXAS1 (0.51) AGERFDPS
SCHEMBL15187295 0.82 TBXAS1 (0.51) AGERFDPS
SCHEMBL15187342 0.82 TBXAS1 (0.51) AGERFDPS
SCHEMBL10730735 0.82 AGER (0.53) AGERFDPSCYP19A1
SCHEMBL11292777 0.82 AGER (0.53) AGERFDPSCYP19A1
SCHEMBL1585079 0.82 AGER (0.53) AGERFDPSCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2173740-A1 HEME-OXYGENASE INHIBITORS AND USE OF THE SAME IN THE TREATMENT OF CANCER AND DISEASES OF THE CENTRAL NERVOUS SYSTEM Osta Biotechnologies (CA) 2010-04-14 EP claimed
WO-2008151437-A1 HEME-OXYGENASE INHIBITORS AND USE OF THE SAME IN THE TREATMENT OF CANCER AND DISEASES OF THE CENTRAL NERVOUS SYSTEM OSTA BIOTECHNOLOGIES (CA) 2008-12-18 WO claimed
EP-0025948-B1 ACYLATED IMIDAZOLYL-GAMMA-FLUOROPINACOLYL DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES BAYER AG (DE) 1983-03-02 EP claimed
US-20140155445-A1 Compounds and Methods for Treating Cancer and Diseases of the Central Nervous System QUEEN'S UNIVERSITY AT KINGSTON (CA) 2014-06-05 US disclosed
US-20140155445-A1 Compounds and Methods for Treating Cancer and Diseases of the Central Nervous System QUEEN'S UNIVERSITY AT KINGSTON (CA) 2014-06-05 US disclosed
US-8513294-B2 Substituted imidazole derivatives and methods of use thereof for treating cancer OSTA BIOTECHNOLOGIES (CA) 2013-08-20 US disclosed
US-8513294-B2 Substituted imidazole derivatives and methods of use thereof for treating cancer OSTA BIOTECHNOLOGIES (CA) 2013-08-20 US disclosed
US-20120020915-A1 Compounds and Methods for Treating Cancer and Diseases of the Central Nervous System QUEENS UNIVERSITY AT KINGSTON (CA) 2012-01-26 US disclosed
US-20120020915-A1 Compounds and Methods for Treating Cancer and Diseases of the Central Nervous System QUEENS UNIVERSITY AT KINGSTON (CA) 2012-01-26 US disclosed
US-20120020915-A1 Compounds and Methods for Treating Cancer and Diseases of the Central Nervous System QUEENS UNIVERSITY AT KINGSTON (CA) 2012-01-26 US disclosed
US-20110319459-A1 Compounds and Methods for Treating Cancer and Diseases of the Central Nervous System OSTA BIOTECHNOLOGIES (CA) 2011-12-29 US disclosed
WO-2001079180-A2 5-SUBSTITUTED TETRALONES AS INHIBITORS OF RAS FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 2001-10-25 WO disclosed
EP-0111384-B1 THIOKETAL SUBSTITUTED N-ALKYL IMIDAZOLES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SYNTEX (U.S.A.) INC. (US) 1987-04-22 EP disclosed
EP-0104300-B1 DIAZOLYL ALKANOLES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTIMYCOTIC AGENTS BAYER AG (DE) 1986-03-26 EP disclosed
US-4518607-A FUNGICIDES, BACXTERICIDES AND ANTIPROTOZOA AGENTS SYNTEX (U.S.A.) INC. (US) 1985-05-21 US disclosed
US-4489087-A Spermicidal thioketal substituted N-alkyl imidazoles SYNTEX (U.S.A.) INC. (US) 1984-12-18 US disclosed
EP-0111384-A1 Thioketal substituted N-alkyl imidazoles and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1984-06-20 EP disclosed
EP-0104300-A1 Diazolyl alkanoles, process for their preparation and their use as antimycotic agents BAYER AG (DE) 1984-04-04 EP disclosed
US-4415586-A FUNGICIDES; MICROBIOCIDES BAYER AKTIENGESELLSCHAFT (DE) 1983-11-15 US disclosed
US-4229459-A Combating fungi with 1-azol-1-yl-1-phenoxy-2-alkane ethers BAYER AKTIENGESELLSCHAFT (DE) 1980-10-21 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-20110319459-A1 Compounds and Methods for Treating Cancer and Diseases of the Central Nervous System TXNRD2, HMOX1, HMOX2 AGER 2741/4885FDPS 1728/4885CYP19A1 884/4885
US-20140155445-A1 Compounds and Methods for Treating Cancer and Diseases of the Central Nervous System HMOX1, HMOX2, CYC1 AGER 2555/4885FDPS 1078/4885CYP19A1 641/4885
US-20120020915-A1 Compounds and Methods for Treating Cancer and Diseases of the Central Nervous System HMOX1, HMOX2, CYC1 AGER 2555/4885FDPS 1078/4885CYP19A1 641/4885

“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.