SCHEMBL7188094

SCHEMBL7188094

CCN(CC)c1ccc(C(c2ncccc2C(=O)OC)c2c(C)n(CC)c3ccccc23)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.36
PTGER4 P35408 4/20 0.36
LMNA P02545 3/20 0.36
HTT P42858 2/20 0.36
STAT3 P40763 1/20 0.36
MAPT P10636 5/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYP19A1 P11511 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NR4A2 P43354 1/20 0.34
GABRP O00591 1/20 0.34
GABRD O14764 1/20 0.34
GABRA1 P14867 1/20 0.34

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
SCHEMBL7191366 0.94 KDM4E (0.40) SMN1; SMN2LMNAHTTSTAT3MAPT
SCHEMBL7185303 0.93 PTGER4 (0.36) SMN1; SMN2PTGER4LMNAKMT2AALDH1A1
SCHEMBL7181782 0.88 MAPT (0.38) SMN1; SMN2PTGER4LMNAHTTMAPT
SCHEMBL7194548 0.85 MAPT (0.35) SMN1; SMN2PTGER4LMNAHTTMAPT
SCHEMBL7194341 0.83 KDM4E (0.37) SMN1; SMN2LMNAMAPTKMT2AALDH1A1
SCHEMBL7187904 0.81 NR4A2 (0.38) SMN1; SMN2PTGER4LMNAHTTMAPT
SCHEMBL5666758 0.80 CYP19A1 (0.42) SMN1; SMN2LMNAHTTMAPTKMT2A
SCHEMBL7188117 0.74 NR4A2 (0.48) SMN1; SMN2PTGER4LMNAHTTMAPT
SCHEMBL7189604 0.74 GABRP (0.37) PTGER4LMNAHTTMAPTKMT2A
SCHEMBL5666766 0.72 CYP19A1 (0.42) SMN1; SMN2LMNAHTTMAPTKMT2A

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-6586364-B2 Shell walls; liquid coloring PENTAX CORPORATION (JP) 2003-07-01 US disclosed
US-20020168580-A1 Heat-sensitive microcapsule and recording medium using same ASAHI KOGAKU KOGYO KABUSHIKI KAISHA 2002-11-14 US disclosed