SCHEMBL4427110

SCHEMBL4427110

CNC(=O)C(C)Oc1ccc(O)cc1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
TSHR P16473 3/20 0.48
LMNA P02545 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
HPGD P15428 1/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
RXFP1 Q9HBX9 1/20 0.45
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL5542446 1.00 ALDH1A1 (0.51) ALDH1A1TSHRLMNATDP1HPGD
SCHEMBL8566301 0.83 MEN1 (0.62) ALDH1A1TSHRTDP1HPGDMEN1
SCHEMBL2558483 0.81 ALDH1A3 (0.58) ALDH1A1LMNATDP1MEN1KMT2A
SCHEMBL9856346 0.81 SMN1; SMN2 (0.49) ALDH1A1LMNATDP1MEN1KMT2A
SCHEMBL11850072 0.80 LMNA (0.52) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL20787503 0.80 GAA (0.53) ALDH1A1LMNATDP1MEN1KMT2A
SCHEMBL14228482 0.79 KMT2A (0.52) ALDH1A1TSHRLMNAHPGDMEN1
SCHEMBL1931468 0.79 KMT2A (0.52) ALDH1A1TSHRLMNAHPGDMEN1
SCHEMBL8431462 0.79 KMT2A (0.52) ALDH1A1TSHRLMNAHPGDMEN1
SCHEMBL10175698 0.79 KDM4E (0.67) ALDH1A1LMNATDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2956437-B1 ALBICIDIN DERIVATIVES FOR THE TREATMENT OF BACTERIAL INFECTIONS UNIV BERLIN TECH (DE) 2023-05-10 EP disclosed
US-11358987-B2 Albicidin derivatives, their use and synthesis Technische Universität Berlin (DE) 2022-06-14 US disclosed
US-11225465-B2 Albicidin derivatives, their use and synthesis Technische Universität Berlin (DE) 2022-01-18 US disclosed
US-20210017229-A1 ALBICIDIN DERIVATIVES, THEIR USE AND SYNTHESIS Technische Universität Berlin (DE) 2021-01-21 US disclosed
US-20200165214-A1 ALBICIDIN DERIVATIVES, THEIR USE AND SYNTHESIS Technische Universität Berlin (DE) 2020-05-28 US disclosed
WO-2019185806-A1 NOVEL ALBICIDIN DERIVATIVES, THEIR USE AND SYNTHESIS Technische Universität Berlin (DE) 2019-10-03 WO disclosed
US-10308595-B2 Albicidin derivatives, their use and synthesis Technische Universität Berlin (DE) 2019-06-04 US disclosed
EP-1761480-B1 MAO-B INHIBITORS HOFFMANN LA ROCHE (CH) 2009-02-18 EP disclosed
US-7253318-B2 Benzyloxy derivatives as MAOB inhibitors HOFFMAN-LA ROCHE INC. (US) 2007-08-07 US disclosed
EP-1761480-A2 NEW MAO-B INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2007-03-14 EP disclosed
WO-2006000324-A2 NEW MAO-B INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2006-01-05 WO disclosed
US-20050288367-A1 Benzyloxy derivatives as MAOB inhibitors HOFFMAN-LA ROCHE INC. 2005-12-29 US disclosed
US-6559102-B1 Applying one or more 3-aryl-pyrazole compounds to undesirable plants, fungi and/or their habitat BAYER AKTIENGESELLSCHAFT (DE) 2003-05-06 US disclosed
US-6495492-B1 HERBICIDES; DEFOLIANTS, DESICCANTS, HAULM KILLERS AND ESPECIALLY WEED KILLERS BAYER AKTIENGESELLSCHAFT (DE) 2002-12-17 US disclosed
CN-1314892-A Substituted 3-aryl-pyrazoles compound BAYER AG (DE) 2001-09-26 CN 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 (6 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-10308595-B2 Albicidin derivatives, their use and synthesis MB, ALB, BCAT2 ALDH1A1 2409/4885TSHR 3877/4885LMNA 3913/4885
US-11225465-B2 Albicidin derivatives, their use and synthesis ALB, AAAS, UGT2B7 ALDH1A1 1068/4885TSHR 3842/4885LMNA 3850/4885
US-20210017229-A1 ALBICIDIN DERIVATIVES, THEIR USE AND SYNTHESIS ALB, UGT2B7, AAAS ALDH1A1 1510/4885TSHR 3991/4885LMNA 3311/4885
US-20050288367-A1 Benzyloxy derivatives as MAOB inhibitors MAOB, MAOA, COMT ALDH1A1 472/4885TSHR 1029/4885LMNA 1325/4885
US-11358987-B2 Albicidin derivatives, their use and synthesis ALB, UGT2B7, AAAS ALDH1A1 1510/4885TSHR 3991/4885LMNA 3311/4885
US-20200165214-A1 ALBICIDIN DERIVATIVES, THEIR USE AND SYNTHESIS ALB, AAAS, UGT2B7 ALDH1A1 1068/4885TSHR 3842/4885LMNA 3850/4885

“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.