SCHEMBL20604653

SCHEMBL20604653

COC(=O)c1ccc(Cn2cc(Br)c3cc(C#N)ccc32)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 4/20 0.51
ALDH1A1 P00352 1/20 0.51
POLB P06746 1/20 0.48
LMNA P02545 2/20 0.47
HTT P42858 2/20 0.47
CYP11B1 P15538 1/20 0.47
CYP11B2 P19099 1/20 0.47
USP2 O75604 1/20 0.46
CNR2 P34972 1/20 0.43
HDAC6 Q9UBN7 3/20 0.43
HDAC10 Q969S8 1/20 0.43
MMP13 P45452 1/20 0.43
HDAC1 Q13547 2/20 0.42
HDAC2 Q92769 2/20 0.42
HDAC8 Q9BY41 2/20 0.42
HDAC9 Q9UKV0 2/20 0.42
APP P05067 1/20 0.42
SNCA P37840 1/20 0.42
MAPT P10636 1/20 0.42
NPSR1 Q6W5P4 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
SCHEMBL22359808 0.87 CYP11B1 (0.47) MAPK10ALDH1A1POLBLMNAHTT
SCHEMBL20604642 0.83 HTT (0.49) ALDH1A1POLBLMNAHTTCYP11B1
SCHEMBL15585968 0.83 CHRNB2 (0.46) POLBLMNAHTT
SCHEMBL20604679 0.81 LMNA (0.45) ALDH1A1POLBLMNAHTTAPP
SCHEMBL4101347 0.79 HDAC6 (0.51) HDAC6HDAC10HDAC1HDAC8HDAC3
SCHEMBL20604674 0.79 LMNA (0.40) ALDH1A1POLBLMNAHTTHDAC6
SCHEMBL20604669 0.79 MEN1 (0.57) ALDH1A1POLBLMNAHTTCNR2
SCHEMBL20604708 0.77 CNR2 (0.46) ALDH1A1POLBHTTCYP11B1CYP11B2
SCHEMBL20604662 0.77 F10 (0.47) ALDH1A1POLBLMNAHTTHDAC6
SCHEMBL20604582 0.77 MRGPRX4 (0.46) ALDH1A1POLBLMNAHTTHDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3423443-B1 CYANO-SUBSTITUTED INDOLE COMPOUNDS AND USES THEREOF AS LSD1 INHIBITORS NOVARTIS AG (CH) 2020-08-19 EP disclosed
US-10590079-B2 Cyano-substituted indoles as LSD1 inhibitors NOVARTIS AG (CH) 2020-03-17 US disclosed
US-20190092724-A1 CYANO-SUBSTITUTED INDOLE COMPOUNDS AND USES THEREOF AS LSD1 INHIBITORS NOVARTIS AG (CH) 2019-03-28 US disclosed
US-20190092724-A1 CYANO-SUBSTITUTED INDOLE COMPOUNDS AND USES THEREOF AS LSD1 INHIBITORS NOVARTIS AG (CH) 2019-03-28 US disclosed
EP-3423443-A1 CYANO-SUBSTITUTED INDOLE COMPOUNDS AND USES THEREOF AS LSD1 INHIBITORS Novartis AG (CH) 2019-01-09 EP 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 (2 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-10590079-B2 Cyano-substituted indoles as LSD1 inhibitors KDM1A, KDM1B, KDM3A MAPK10 1546/4885ALDH1A1 337/4885POLB 2640/4885
US-20190092724-A1 CYANO-SUBSTITUTED INDOLE COMPOUNDS AND USES THEREOF AS LSD1 INHIBITORS KDM1A, KDM1B, KDM2A MAPK10 1586/4885ALDH1A1 270/4885POLB 3167/4885

“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.