SCHEMBL20144280

SCHEMBL20144280

CN1CCC(C(=O)NCCc2ccc(O)cc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.58
HPGD P15428 1/20 0.58
CYP2C19 P33261 1/20 0.56
TSHR P16473 3/20 0.56
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
KDM4E B2RXH2 2/20 0.53
F13A1 P00488 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
HTT P42858 1/20 0.52
LMNA P02545 1/20 0.52
MAPK1 P28482 1/20 0.52
POLB P06746 1/20 0.51

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
SCHEMBL13621122 0.87 CYP2C19 (0.72) ALDH1A1HPGDCYP2C19TSHRMEN1
SCHEMBL13060934 0.86 ALDH1A1 (0.59) ALDH1A1HPGDCYP2C19TSHRMEN1
SCHEMBL13006889 0.85 ALDH1A1 (0.55) ALDH1A1HPGDCYP2C19TSHRMEN1
SCHEMBL10285704 0.85 KDM4E (0.57) ALDH1A1HPGDCYP2C19TSHRMEN1
SCHEMBL24334501 0.80 ALDH1A1 (0.53) ALDH1A1HPGDCYP2C19TSHRMEN1
SCHEMBL13746185 0.80 CYP2C19 (0.62) ALDH1A1HPGDCYP2C19TSHRMEN1
SCHEMBL23928125 0.79 POLB (0.52) ALDH1A1HPGDCYP2C19TSHRMEN1
SCHEMBL11769350 0.79 ALDH1A1 (0.53) ALDH1A1TSHRMEN1KMT2AKDM4E
SCHEMBL20160095 0.77 CYP2C19 (0.59) ALDH1A1HPGDCYP2C19TSHRMEN1
SCHEMBL17285877 0.77 TMEM97 (0.47) MEN1KMT2AKDM4EF13A1

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
US-20220178934-A1 SIGNALING CONJUGATES AND METHODS OF USE VENTANA MED SYST INC (US) 2022-06-09 US disclosed
EP-3764084-A1 DIGITALLY ENHANCED MICROSCOPY FOR MULTIPLEXED HISTOLOGY Ventana Medical Systems, Inc. (US) 2021-01-13 EP disclosed
EP-3764083-A1 DIGITALLY ENHANCED MICROSCOPY FOR MULTIPLEXED HISTOLOGY Ventana Medical Systems, Inc. (US) 2021-01-13 EP disclosed
EP-2972227-B1 DIGITALLY ENHANCED MICROSCOPY FOR MULTIPLEXED HISTOLOGY VENTANA MED SYST INC (US) 2020-05-06 EP disclosed
EP-2831587-B1 SIGNALING CONJUGATES AND METHODS OF USE VENTANA MED SYST INC (US) 2018-05-16 EP disclosed