SCHEMBL6325435

SCHEMBL6325435

Cc1cccc(OP(=O)(Oc2cccc(C)c2)c2ccccc2NC(=O)NS(=O)(=O)C2CCCCC2)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
RAB9A P51151 4/20 0.36
NPC1 O15118 3/20 0.36
MRGPRX1 Q96LB2 2/20 0.36
LMNA P02545 2/20 0.36
PLA2G1B P04054 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
CHRM3 P20309 2/20 0.35
PYGL P06737 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
SCHEMBL7599829 0.82 KDM4E (0.41) MEN1KMT2ATSHRNPSR1ALDH1A1
SCHEMBL6325457 0.80 MRGPRX1 (0.41) MEN1KMT2AMAPTTSHRMRGPRX1
SCHEMBL6331130 0.80 MRGPRX1 (0.41) MEN1KMT2ATSHRALDH1A1MRGPRX1
SCHEMBL6324376 0.78 MRGPRX1 (0.43) MEN1KMT2ANPSR1ALDH1A1RAB9A
SCHEMBL6323916 0.77 MRGPRX1 (0.40) MEN1KMT2AALDH1A1MRGPRX1
SCHEMBL6330219 0.70 MEN1 (0.36) MEN1KMT2AL3MBTL1MAPTTSHR
SCHEMBL6323776 0.70 L3MBTL1 (0.42) MEN1KMT2AL3MBTL1MAPTTSHR
SCHEMBL6324447 0.70 KMT2A (0.40) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL6321845 0.69 KDM4E (0.43) MEN1KMT2ATSHRNPSR1ALDH1A1
SCHEMBL20118984 0.68 NPC1 (0.57) MEN1KMT2AMAPK1NPSR1ALDH1A1

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-6924284-B2 PARP inhibitors ICOS CORPORATION (US) 2005-08-02 US disclosed
US-6858565-B2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2005-02-22 US disclosed
US-20030040434-A1 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2003-02-27 US disclosed
EP-1264707-A2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2002-12-11 EP disclosed