SCHEMBL7293185

SCHEMBL7293185

CCOC(=O)[C@H]1NCC(=S)C1C(=O)[C@@H]1CCCN1C(=O)CCCCC1Cc2ccc(Cl)cc2C1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
MAPK1 P28482 1/20 0.36
RECQL P46063 1/20 0.36
ALDH1A1 P00352 4/20 0.34
HTR1A P08908 2/20 0.34
HTR7 P34969 2/20 0.34
CPT2 P23786 1/20 0.34
CPT1A P50416 1/20 0.34
PREP P48147 1/20 0.34
F2 P00734 2/20 0.33
POLB P06746 1/20 0.32
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
KDM4E B2RXH2 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL7301966 0.82 HTR1A (0.34) MAPK1ALDH1A1HTR1AHTR7MAPT
SCHEMBL7301136 0.74 MEN1 (0.32) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL9048219 0.74 PREP (0.43) HTR1AHTR7PREP
SCHEMBL7302892 0.73 PREP (0.42) ALDH1A1HTR1AHTR7CPT2CPT1A
SCHEMBL7302819 0.73 PREP (0.31) ALDH1A1PREPKDM4ESMN1; SMN2
SCHEMBL9046582 0.71 PREP (0.44) HTR1AHTR7PREP
SCHEMBL7294376 0.70 ALDH1A1 (0.32) MAPK1ALDH1A1POLBMEN1KMT2A
SCHEMBL9046480 0.68 PREP (0.46) PREPF2
SCHEMBL9048411 0.68 PREP (0.46) PREPF2
SCHEMBL9049491 0.68 PREP (0.45) PREPF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0372484-B1 Condensed benzene derivative ZERIA PHARM CO LTD (JP) 1994-10-26 EP disclosed
US-5028604-A Cognition Activators ZERIA PHARMACEUTICAL CO., LTD. (JP) 1991-07-02 US disclosed
EP-0372484-A2 Condensed benzene derivative ZERIA PHARMACEUTICAL CO., LTD. (JP) 1990-06-13 EP disclosed