SCHEMBL7688505

SCHEMBL7688505

CCCCCN1CCN(CCCN2C(=O)c3cccc4cccc(c34)C2=O)CC1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.65
LMNA P02545 2/20 0.65
MAPK1 P28482 1/20 0.65
DRD2 P14416 7/20 0.63
HTR1A P08908 6/20 0.63
HTR2A P28223 6/20 0.63
HTR6 P50406 6/20 0.63
DRD3 P35462 1/20 0.63
HTR7 P34969 6/20 0.62
HEXA P06865 2/20 0.59
HEXB P07686 2/20 0.59
RAD52 P43351 2/20 0.57
POLB P06746 2/20 0.57
NR1I2 O75469 1/20 0.57
AHR P35869 1/20 0.57
RCE1 Q9Y256 1/20 0.57
RXFP1 Q9HBX9 1/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56

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
SCHEMBL12413492 0.93 KDM4E (0.66) KDM4ELMNAMAPK1DRD2HTR1A
SCHEMBL2363008 0.90 HEXA (0.71) KDM4EHEXAHEXBRAD52POLB
SCHEMBL14560557 0.89 HEXA (0.69) KDM4EHEXAHEXBRAD52POLB
SCHEMBL20893694 0.89 HEXA (0.69) KDM4EHEXAHEXBRAD52POLB
SCHEMBL9625295 0.89 HEXA (0.69) KDM4EHEXAHEXBRAD52POLB
SCHEMBL9627022 0.89 HEXA (0.69) KDM4EHEXAHEXBRAD52POLB
SCHEMBL9625427 0.89 HEXA (0.69) KDM4EHEXAHEXBRAD52POLB
SCHEMBL1657181 0.89 HEXA (0.69) KDM4EHEXAHEXBRAD52POLB
SCHEMBL9625491 0.89 HEXA (0.69) KDM4EHEXAHEXBRAD52POLB
SCHEMBL11455625 0.89 HEXA (0.69) KDM4EHEXAHEXBRAD52POLB

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-6420366-B1 PERIPHERAL VASCULAR DISEASE, CONGESTIVE HEART FAILURE, HYPERTENSION AND ESPECIALLY BENIGN PROSTATIC HYPERTROPHY. RANBAXY LABORATORIES LIMITED (IN) 2002-07-16 US disclosed
US-6410735-B1 CONGESTIVE HEART FAILURE; HYPOTENSIVE AGENTS; BENGIN PROSTATIC HYPERPLASIA RANBAXY LABORATORIES LIMITED (IN) 2002-06-25 US disclosed
US-6090809-A 1-(4-arylpiperazin-1-yl)-ω-[n-(α..omega.-dicarboximido)]-alkanes useful as uro-selective α1 -adrenoceptor blockers RANBAXY LABORATORIES LIMITED (IN) 2000-07-18 US disclosed
US-6083950-A TREATMENT OF PERIPHERAL VASCULAR DISEASE, CONGESTIVE HEART FAILURE, HYPERTENSION AND ESPECIALLY BENIGN PROSTATIC HYPERTROPHY RANBAXY LABORATORIES LIMITED (IN) 2000-07-04 US disclosed