SCHEMBL8610413

SCHEMBL8610413

CCC1(c2c[nH]cn2)Cc2ccccc2C1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.43
GAA P10253 3/20 0.39
KDM4E B2RXH2 3/20 0.39
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KMT2A Q03164 4/20 0.37
PRNP P04156 2/20 0.36
PPARG P37231 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
NR2E3 Q9Y5X4 1/20 0.36
NCOR2 Q9Y618 1/20 0.36
MEN1 O00255 3/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL9431991 0.90 NPSR1 (0.40) NPSR1GAAKDM4ELMNAHTT
SCHEMBL8611233 0.82 CYP19A1 (0.39) NPSR1
SCHEMBL7639950 0.82 ADRA2A (0.37) KMT2AHTR2AHTR2CMAPT
SCHEMBL8614549 0.82 AKR1B1 (0.34) HTR2AHTR2CMAPT
SCHEMBL6249669 0.81 MEN1 (0.39) GAAKDM4ELMNAHTTL3MBTL1
SCHEMBL8611882 0.79 ALDH1A1 (0.39) LMNAHTTKMT2AMEN1ALDH1A1
SCHEMBL8616201 0.79 KDM4E (0.39) NPSR1GAAKDM4ELMNAHTT
SCHEMBL9326720 0.77 NPSR1 (0.40) NPSR1GAAKDM4ELMNAHTT
SCHEMBL6250022 0.74 LMNA (0.44) NPSR1KDM4ELMNAHTTL3MBTL1
SCHEMBL856677 0.74 LMNA (0.39) NPSR1GAALMNAHTTL3MBTL1

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-0618906-B1 SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR PREPARATION AND USE JUVANTIA PHARMA LTD OY (FI) 1998-04-22 EP disclosed
US-5498623-A MULTISTAGE REACTION FOR HALOGENATION OF COMPOUNDS, NITRATION, REDUCTION AND CONVERSION TO DIAZONIUM SALT THEN HALOGENATION FOR COGNITIVE DISORDERS ORION-YHTYMA OY (FI) 1996-03-12 US disclosed
EP-0372954-B1 Substituted imidazole derivatives and their preparation and use ORION YHTYMAE OY (FI) 1994-03-09 EP disclosed
US-5292887-A Antgonists at postsynoptic adrenoreceptors; hypotensive and antidiabetic agents FARMOS-YHTYMA OY (FI) 1994-03-08 US disclosed
EP-0372954-A1 Substituted imidazole derivatives and their preparation and use ORION-YHTYMÀ„ OY (FI) 1990-06-13 EP disclosed