SCHEMBL7943338

SCHEMBL7943338

CN1CCN(c2cccc3c2cc(C(=O)NCc2ccc(Cl)cc2)n3C)CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 3/20 0.59
THRB P10828 2/20 0.59
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 5/20 0.48
NPSR1 Q6W5P4 1/20 0.48
NPBWR1 P48145 1/20 0.47
MCHR1 Q99705 1/20 0.47
TP53 P04637 4/20 0.46
HPGD P15428 3/20 0.46
HSD17B10 Q99714 3/20 0.46
KDM4E B2RXH2 2/20 0.46
POLB P06746 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPC1 O15118 1/20 0.45
ALOX15 P16050 1/20 0.45
LMNA P02545 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 1/20 0.43

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
SCHEMBL4998178 0.82 RXFP1 (0.67) RXFP1THRBMEN1KMT2AALDH1A1
SCHEMBL6308076 0.80 KMT2A (0.53) KMT2AALDH1A1NPSR1NPBWR1MCHR1
SCHEMBL7951589 0.79 KMT2A (0.51) MEN1KMT2ANPBWR1MCHR1NPC1
SCHEMBL7943447 0.76 MCL1 (0.48) MEN1KMT2AALDH1A1HSD17B10KDM4E
SCHEMBL13838674 0.74 RXFP1 (1.00) RXFP1THRBMEN1KMT2AALDH1A1
SCHEMBL7838686 0.73 HTR1A (0.55) ALDH1A1NPBWR1MCHR1HPGDHSD17B10
SCHEMBL7943441 0.73 RXFP1 (0.44) RXFP1ALDH1A1HSD17B10KDM4ESMN1; SMN2
SCHEMBL7803909 0.73 KMT2A (0.52) RXFP1THRBMEN1KMT2ANPSR1
SCHEMBL7159289 0.72 HPGD (0.60) ALDH1A1NPSR1NPBWR1MCHR1HPGD
SCHEMBL7158128 0.72 NPBWR1 (0.48) MEN1KMT2AALDH1A1NPSR1NPBWR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6255306-B1 PSYCHOLOGICAL DISORDERS MACOR JOHN E (US) 2001-07-03 US claimed
EP-0773942-A1 4-INDOLE DERIVATIVES AS SEROTONIN AGONISTS AND ANTAGONISTS PFIZER INC. (US) 1997-05-21 EP claimed
WO-1996003400-A1 4-INDOLE DERIVATIVES AS SEROTONIN AGONISTS AND ANTAGONISTS PFIZER INC. (US) 1996-02-08 WO claimed
US-6255306-B1 PSYCHOLOGICAL DISORDERS MACOR JOHN E (US) 2001-07-03 US disclosed
EP-0773942-A1 4-INDOLE DERIVATIVES AS SEROTONIN AGONISTS AND ANTAGONISTS PFIZER INC. (US) 1997-05-21 EP disclosed
WO-1996003400-A1 4-INDOLE DERIVATIVES AS SEROTONIN AGONISTS AND ANTAGONISTS PFIZER INC. (US) 1996-02-08 WO disclosed