SCHEMBL8397405

SCHEMBL8397405

CC=CC(=O)OCCCOc1cc(-n2nc3ccc(C)cc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.35
RAB9A P51151 5/20 0.35
MAPT P10636 5/20 0.35
NPC1 O15118 4/20 0.34
ALDH1A1 P00352 4/20 0.34
HPGD P15428 3/20 0.34
TDP1 Q9NUW8 2/20 0.34
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
LMNA P02545 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
IGF2BP2 Q9Y6M1 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL20580264 0.95 RAB9A (0.35) KDM4ERAB9AMAPTNPC1ALDH1A1
SCHEMBL2778925 0.90 HDAC8 (0.34) RAB9AMAPTNPC1SMN1; SMN2LMNA
SCHEMBL7177419 0.85 THRB (0.39) KDM4ERAB9AMAPTNPC1ALDH1A1
SCHEMBL8397404 0.85 TDP1 (0.37) KDM4ERAB9AMAPTNPC1ALDH1A1
SCHEMBL23638712 0.83 NPC1 (0.37) KDM4ERAB9AMAPTNPC1ALDH1A1
SCHEMBL8400550 0.82 NPC1 (0.38) KDM4ERAB9AMAPTNPC1ALDH1A1
SCHEMBL18280470 0.80 KDM4E (0.35) KDM4EMAPTALDH1A1HPGDSMN1; SMN2
SCHEMBL20494988 0.80 ALOX5 (0.30)
SCHEMBL373843 0.80 NPC1 (0.35) KDM4ERAB9AMAPTNPC1ALDH1A1
SCHEMBL29613654 0.80 NPC1 (0.35) KDM4ERAB9AMAPTNPC1ALDH1A1

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
EP-0488145-B1 Ultraviolet light absorbing intraocular lens MENICON CO LTD (JP) 1999-06-09 EP claimed
EP-0488145-A2 Ultraviolet light absorbing ocular lens Menicon Co., Ltd. (JP) 1992-06-03 EP claimed
EP-0488145-B1 Ultraviolet light absorbing intraocular lens MENICON CO LTD (JP) 1999-06-09 EP disclosed
EP-0488145-A2 Ultraviolet light absorbing ocular lens Menicon Co., Ltd. (JP) 1992-06-03 EP disclosed