SCHEMBL23866681

SCHEMBL23866681

COc1ccc(Oc2ccc(N(c3ccc(-c4ccc(N(c5ccc(Oc6ccc(OC)cc6)cc5)c5ccc(C(C)(C)C)cc5)cc4)cc3)c3ccc(C(C)(C)C)cc3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
MAPT P10636 3/20 0.49
MAPK1 P28482 2/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
HPGD P15428 1/20 0.49
LMNA P02545 2/20 0.44
ALOX15 P16050 1/20 0.44
APEX1 P27695 1/20 0.44
RECQL P46063 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
HSP90AA1 P07900 1/20 0.42
HSP90AB1 P08238 1/20 0.42
LTA4H P09960 2/20 0.41
ESR2 Q92731 1/20 0.40
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
FGFR2 P21802 1/20 0.40
NPBWR1 P48145 1/20 0.39

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
SCHEMBL10057795 0.95 MAPT (0.49) ALDH1A1MAPTMAPK1NPC1RAB9A
SCHEMBL23866680 0.95 MAPT (0.49) ALDH1A1MAPTMAPK1NPC1RAB9A
SCHEMBL12606779 0.89 NPSR1 (0.47) ALDH1A1MAPTMAPK1NPC1RAB9A
SCHEMBL10025023 0.89 TSHR (0.48) ALDH1A1MAPTMAPK1NPC1RAB9A
SCHEMBL23866714 0.88 LTA4H (0.52) ALDH1A1MAPTMAPK1NPC1RAB9A
SCHEMBL2608411 0.84 MAPT (0.58) ALDH1A1MAPTMAPK1NPC1RAB9A
SCHEMBL9729672 0.84 ALDH1A1 (0.65) ALDH1A1MAPTMAPK1NPC1RAB9A
SCHEMBL8642413 0.82 KIF11 (0.54) ALDH1A1NPC1RAB9AHPGDLMNA
SCHEMBL16343998 0.82 KIF11 (0.54) ALDH1A1NPC1RAB9AHPGDLMNA
SCHEMBL12951069 0.82 KIF11 (0.54) ALDH1A1NPC1RAB9AHPGDLMNA

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
EP-3889130-A1 ELECTROCHROMIC ELEMENT Ricoh Company, Ltd. (JP) 2021-10-06 EP disclosed
US-20210301197-A1 ELECTROCHROMIC ELEMENT RICOH COMPANY, LTD. (JP) 2021-09-30 US disclosed