SCHEMBL6562293

SCHEMBL6562293

COc1ccc(CCNNCCc2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
ATM Q13315 1/20 0.62
LTA4H P09960 1/20 0.62
BCHE P06276 2/20 0.60
NPC1 O15118 1/20 0.59
GAA P10253 1/20 0.59
RAB9A P51151 1/20 0.59
TAAR1 Q96RJ0 1/20 0.59
ALDH1A1 P00352 1/20 0.59
POLB P06746 1/20 0.59
PLAAT3 P53816 2/20 0.59
PLAAT5 Q96KN8 2/20 0.59
PLAAT2 Q9NWW9 2/20 0.59
PLAAT4 Q9UL19 2/20 0.59
SIGMAR1 Q99720 1/20 0.56
FPR2 P25090 1/20 0.56
PTPN1 P18031 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL4614753 0.89 MEN1 (0.71) MEN1KMT2AATMLTA4HBCHE
SCHEMBL2355634 0.86 LTA4H (0.75) MEN1KMT2AATMLTA4HNPC1
SCHEMBL10032816 0.84 MEN1 (0.85) MEN1KMT2AATMLTA4HBCHE
SCHEMBL12131075 0.84 MEN1 (0.85) MEN1KMT2AATMLTA4HBCHE
SCHEMBL3621768 0.82 SIGMAR1 (0.70) MEN1KMT2AATMBCHEPLAAT3
SCHEMBL5632470 0.82 LTA4H (0.69) LTA4HNPC1RAB9ATAAR1ALDH1A1
SCHEMBL6226359 0.81 MAPT (0.73) MEN1KMT2AATMLTA4HBCHE
SCHEMBL8099595 0.81 SIGMAR1 (0.68) MEN1KMT2AATMLTA4HBCHE
SCHEMBL3911045 0.81 MAPT (0.73) MEN1KMT2AATMLTA4HBCHE
SCHEMBL15279365 0.81 BCHE (0.61) MEN1KMT2AATMLTA4HBCHE

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
WO-2020130592-A1 METAL HALIDE PEROVSKITE LIGHT EMITTING DEVICE AND METHOD FOR MANUFACTURING SAME 서울대학교산학협력단 2020-06-25 WO disclosed
EP-1085009-B1 INDAN DERIVATIVES NISSAN CHEMICAL IND LTD (JP) 2004-11-10 EP disclosed
US-6486178-B1 Indane derivatives NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2002-11-26 US disclosed
EP-1085009-A1 INDAN DERIVATIVES Nissan Chemical Industries, Ltd. (JP) 2001-03-21 EP disclosed