SCHEMBL535406

SCHEMBL535406

[CH2]Oc1ccc(C#N)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.48
CA9 Q16790 2/20 0.48
CA1 P00915 2/20 0.48
MAOB P27338 3/20 0.47
ALDH1A1 P00352 2/20 0.46
CYP2A6 P11509 2/20 0.46
CA12 O43570 1/20 0.46
CA3 P07451 1/20 0.46
CA6 P23280 1/20 0.46
CA14 Q9ULX7 1/20 0.46
PARP15 Q460N3 1/20 0.44
PARP10 Q53GL7 1/20 0.44
PARP2 Q9UGN5 1/20 0.44
TSHR P16473 1/20 0.43
MAPT P10636 2/20 0.42
CYP19A1 P11511 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL23566017 0.78 CA2 (0.52) CA2CA9CA1MAOBALDH1A1
SCHEMBL7041250 0.78 PARP15 (0.63) CA2CA9CA1MAOBALDH1A1
SCHEMBL8852392 0.78 PARP15 (0.63) CA2CA9CA1MAOBALDH1A1
Water SCHEMBL28254092 0.76 CA2 (0.69) CA2CA9CA1MAOBALDH1A1
Water SCHEMBL28189314 0.76 CA2 (0.69) CA2CA9CA1MAOBALDH1A1
SCHEMBL45942 0.76 CA2 (0.69) CA2CA9CA1MAOBALDH1A1
SCHEMBL2503454 0.76 CA2 (0.69) CA2CA9CA1MAOBALDH1A1
SCHEMBL535440 0.75 MAOB (0.53) CA2CA9CA1MAOBALDH1A1
SCHEMBL14659838 0.75 PARP15 (0.55) CA2CA9CA1ALDH1A1CA12
SCHEMBL6743457 0.74 TTR (0.36) CA2CA9CA1TSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110669058-A Tricyclic quinolone carboxylic acid and preparation method thereof 江西农业大学 2020-01-10 CN claimed
US-20170342070-A1 CYCLOPROPYLAMINES AS LSD1 INHIBITORS INCYTE CORPORATION 2017-11-30 US claimed
EP-3105218-A1 CYCLOPROPYLAMINES AS LSD1 INHIBITORS Incyte Corporation (US) 2016-12-21 EP claimed
WO-2015123465-A1 CYCLOPROPYLAMINES AS LSD1 INHIBITORS INCYTE CORPORATION (US) 2015-08-20 WO claimed
US-20150225401-A1 CYCLOPROPYLAMINES AS LSD1 INHIBITORS INCYTE CORPORATION (US) 2015-08-13 US claimed
EP-1304325-A1 5-(M-CYANOBENZYLAMINO)PYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-04-23 EP claimed
US-11247992-B2 Cyclopropylamines as LSD1 inhibitors INCYTE CORPORATION (US) 2022-02-15 US disclosed
EP-3626713-B1 CYCLOPROPYLAMINES FOR USE AS LSD1 INHIBITORS INCYTE CORP (US) 2021-09-29 EP disclosed
EP-3806836-A1 AMIDINES AND AMIDINE ANALOGS FOR THE TREATMENT OF BACTERIAL INFECTIONS AND POTENTIATION ANTIBIOTICS Georgia State University Research Foundation, Inc. (US) 2021-04-21 EP disclosed
US-20210032244-A1 CYCLOPROPYLAMINES AS LSD1 INHIBITORS INCYTE CORPORATION 2021-02-04 US disclosed
US-10717737-B2 Cyclopropylamines as LSD1 inhibitors INCYTE CORPORATION (US) 2020-07-21 US disclosed
EP-3626713-A1 CYCLOPROPYLAMINES AS LSD1 INHIBITORS Incyte Corporation (US) 2020-03-25 EP disclosed
CN-110669058-A Tricyclic quinolone carboxylic acid and preparation method thereof 江西农业大学 2020-01-10 CN disclosed
US-4081440-A Sulfinyl halides and their preparation from penicillin sulfoxides ELI LILLY AND COMPANY (US) 1978-03-28 US disclosed
US-4075203-A Process for preparing a 3-exomethylenecepham sulfoxide from penicillin sulfoxides ELI LILLY AND COMPANY (US) 1978-02-21 US disclosed
US-4048162-A Process for preparing 3-hydroxy cephalosporins ELI LILLY AND COMPANY (US) 1977-09-13 US disclosed
US-4031082-A Process for preparing 3-acycloxymethyl-2-cephem compounds ELI LILLY AND COMPANY (US) 1977-06-21 US disclosed
US-4029651-A ESTERIFICATION ELI LILLY AND COMPANY (US) 1977-06-14 US disclosed
US-4008230-A Process for preparing 3-hydroxy cephalosporins ELI LILLY AND COMPANY (US) 1977-02-15 US disclosed
US-4008231-A Preparation of 3-methoxymethylcephalosporins ELI LILLY AND COMPANY (US) 1977-02-15 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 (5 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-20150225401-A1 CYCLOPROPYLAMINES AS LSD1 INHIBITORS KDM1B, KDM1A, KDM2A CA2 4109/4885CA9 3913/4885CA1 4279/4885
US-10717737-B2 Cyclopropylamines as LSD1 inhibitors KDM1B, KDM1A, KDM2A CA2 4109/4885CA9 3913/4885CA1 4279/4885
US-20170342070-A1 CYCLOPROPYLAMINES AS LSD1 INHIBITORS KDM1B, KDM1A, KDM2A CA2 4109/4885CA9 3913/4885CA1 4279/4885
US-11247992-B2 Cyclopropylamines as LSD1 inhibitors KDM1B, KDM1A, KDM2A CA2 4109/4885CA9 3913/4885CA1 4279/4885
US-20210032244-A1 CYCLOPROPYLAMINES AS LSD1 INHIBITORS KDM1B, KDM1A, KDM2A CA2 4109/4885CA9 3913/4885CA1 4279/4885

“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.