SCHEMBL7645837

SCHEMBL7645837

N#Cc1ccc(C(=O)Nc2[c]cccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.52
RAB9A P51151 3/20 0.52
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
CYP11B1 P15538 1/20 0.52
CYP11B2 P19099 1/20 0.52
ALDH1A1 P00352 2/20 0.47
MMP1 P03956 1/20 0.47
NAMPT P43490 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MLYCD O95822 1/20 0.47
F2 P00734 1/20 0.46
PLG P00747 1/20 0.46
PLAU P00749 1/20 0.46
KLKB1 P03952 1/20 0.46
PRSS1 P07477 1/20 0.46
KDM4E B2RXH2 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL429187 0.82 PTPN1 (0.48) NPC1RAB9AKMT2AMEN1NAMPT
SCHEMBL7641330 0.80 NPC1 (0.53) NPC1RAB9AALDH1A1NAMPTLMNA
SCHEMBL7641652 0.80 MEN1 (0.59) NPC1RAB9AKMT2AMEN1CYP11B1
SCHEMBL11490610 0.80 NPC1 (0.53) NPC1RAB9AKMT2AMEN1CYP11B1
SCHEMBL8417469 0.77 MMP1 (0.65) NPC1RAB9AKMT2AMEN1CYP11B1
SCHEMBL10933418 0.76 CACNA1B (0.64) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL7640108 0.76 F10 (0.62) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL3190254 0.76 MEN1 (0.68) NPC1RAB9AKMT2AMEN1CYP11B1
SCHEMBL7644336 0.75 MEN1 (0.57) NPC1RAB9AKMT2AMEN1CYP11B1
SCHEMBL3195302 0.74 MLYCD (0.63) NPC1RAB9AKMT2AMEN1CYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6469003-B1 COMPOUNDS HAVING CELL ADHESION INHIBITING ACTIVITY NIHON NOHYAKU CO., LTD. (JP) 2002-10-22 US disclosed
EP-1130015-A1 PYRIDAZINONE DERIVATIVES Nihon Nohyaku Co., Ltd. (JP) 2001-09-05 EP disclosed