SCHEMBL959149

SCHEMBL959149

Cc1ccc(Nc2cc(NC(=O)C3CCCCC3)c3ccccc3n2)cc1.O=C(Nc1cc(Nc2ccc3c(c2)CCC3)nc2ccccc12)C1CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 6/20 0.53
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
MAPT P10636 5/20 0.45
TP53 P04637 3/20 0.45
USP2 O75604 1/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
GAA P10253 2/20 0.43
POLB P06746 1/20 0.43
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 2/20 0.42
HSD17B10 Q99714 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL243470 0.94 RXFP1 (0.59) RXFP1KMT2AMEN1MAPTTP53
SCHEMBL247393 0.93 RXFP1 (0.57) RXFP1KMT2AMEN1MAPTTP53
SCHEMBL1976142 0.92 RXFP1 (0.53) RXFP1KMT2AMAPTTP53NPC1
SCHEMBL935627 0.91 RXFP1 (0.51) RXFP1KMT2AMAPTTP53NPC1
SCHEMBL196310 0.86 RXFP1 (0.47) RXFP1KMT2AMAPTTP53NPC1
SCHEMBL959150 0.85 MEN1 (0.48) RXFP1KMT2AMEN1MAPTTP53
SCHEMBL196063 0.84 RXFP1 (0.60) RXFP1KMT2AMEN1MAPTNPC1
SCHEMBL196744 0.83 MAPT (0.58) RXFP1KMT2AMEN1MAPTNPC1
SCHEMBL196512 0.81 MAPT (0.55) RXFP1KMT2AMEN1MAPTNPC1
SCHEMBL196681 0.81 RXFP1 (0.53) RXFP1KMT2AMEN1MAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9668959-B2 A3 adenosine receptor ligands for modulation of pigmentation ORADIN PHARMACEUTICAL LTD. (IL) 2017-06-06 US disclosed
EP-2456419-B1 A3 ADENOSINE RECEPTOR LIGANDS FOR MODULATION OF PIGMENTATION ORADIN PHARMACEUTICAL LTD (IL) 2016-11-23 EP disclosed
US-20160136079-A1 A3 ADENOSINE RECEPTOR LIGANDS FOR MODULATION OF PIGMENTATION ORADIN PHARMACEUTICAL LTD. (IL) 2016-05-19 US disclosed
US-9199102-B2 A3 adenosine receptor ligands for modulation of pigmentation ORADIN PHARMACEUTICAL LTD. (IL) 2015-12-01 US disclosed
US-20120134945-A1 A3 ADENOSINE RECEPTOR LIGANDS FOR MODULATION OF PIGMENTATION ORADIN PHARMACEUTICAL LTD. (IL) 2012-05-31 US disclosed
EP-2456419-A1 A3 ADENOSINE RECEPTOR LIGANDS FOR MODULATION OF PIGMENTATION Oradin Pharmaceutical Ltd. (IL) 2012-05-30 EP disclosed
WO-2011010306-A1 A3 ADENOSINE RECEPTOR LIGANDS FOR MODULATION OF PIGMENTATION RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2011-01-27 WO disclosed