SCHEMBL7402174

SCHEMBL7402174

CCN1CCSC(c2ccc(Cl)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.49
KMT2A Q03164 4/20 0.47
BRD4 O60885 1/20 0.42
ALDH1A1 P00352 4/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
DUSP3 P51452 1/20 0.41
PTPN5 P54829 1/20 0.41
PTPN11 Q06124 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
NOS3 P29474 1/20 0.38
NOS1 P29475 1/20 0.38
NOS2 P35228 1/20 0.38
LSS P48449 1/20 0.38
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MEN1 O00255 3/20 0.37
SLC6A3 Q01959 1/20 0.37
KDM4E B2RXH2 1/20 0.36
SIGMAR1 Q99720 1/20 0.35

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
SCHEMBL7399918 0.90 DRD2 (0.63) DRD2BRD4NOS3NOS1NOS2
SCHEMBL7402278 0.82 DRD2 (0.50) DRD2KMT2ABRD4ALDH1A1MAPT
SCHEMBL7403885 0.80 LSS (0.47) DRD2LSSSLC6A3L3MBTL1
Hydrochloric Acid SCHEMBL7398529 0.78 LSS (0.46) DRD2LSSSLC6A3L3MBTL1
SCHEMBL10287616 0.77 DRD2 (0.77) DRD2KMT2AALDH1A1MAPTHPGD
SCHEMBL7401016 0.74 DRD2 (0.66) DRD2BRD4
SCHEMBL7398081 0.73 SIGMAR1 (0.50) DRD2KMT2AMEN1SLC6A3SIGMAR1
SCHEMBL14266745 0.69 MAOA (0.49) DRD2KMT2AALDH1A1MAPTLMNA
SCHEMBL10800732 0.68 LMNA (0.42) KMT2AALDH1A1LMNANPSR1MEN1
SCHEMBL19562787 0.68 LMNA (0.42) KMT2AALDH1A1LMNANPSR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5206233-A Antidepressants, antiischemic agents WARNER-LAMBERT COMPANY (US) 1993-04-27 US claimed
WO-1993004053-A1 SUBSTITUTED THIAZEPINES AS CENTRAL NERVOUS SYSTEM AGENTS WARNER-LAMBERT COMPANY (US) 1993-03-04 WO claimed
US-5206233-A Antidepressants, antiischemic agents WARNER-LAMBERT COMPANY (US) 1993-04-27 US disclosed
WO-1993004053-A1 SUBSTITUTED THIAZEPINES AS CENTRAL NERVOUS SYSTEM AGENTS WARNER-LAMBERT COMPANY (US) 1993-03-04 WO disclosed