SCHEMBL2580908

SCHEMBL2580908

[CH2]c1cc(OC)cc(-n2nc3ccc(F)cc3n2)c1O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.35
RAB9A P51151 7/20 0.35
MAPT P10636 3/20 0.34
AMY1A P0DUB6 2/20 0.33
HTT P42858 1/20 0.33
LMNA P02545 3/20 0.32
CASP3 P42574 2/20 0.32
SENP8 Q96LD8 2/20 0.32
SENP7 Q9BQF6 2/20 0.32
SENP6 Q9GZR1 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
DHODH Q02127 1/20 0.32
PLA2G2A P14555 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL21314229 0.88 HTT (0.39) NPC1RAB9AMAPTHTTLMNA
SCHEMBL2589600 0.86 NPC1 (0.43) NPC1RAB9AMAPTHTTLMNA
SCHEMBL2587974 0.85 NPC1 (0.40) NPC1RAB9AMAPTAMY1AHTT
SCHEMBL9100960 0.84 CACNA1D (0.39) NPC1RAB9AL3MBTL1KDM4EPOLB
SCHEMBL1100175 0.82 KDM4E (0.35) NPC1RAB9AMAPTAMY1AHTT
SCHEMBL825195 0.76 MAPT (0.32) NPC1RAB9AMAPTLMNACASP3
SCHEMBL29823665 0.76 MAPT (0.32) NPC1RAB9AMAPTLMNACASP3
SCHEMBL20943569 0.76 POLB (0.35) NPC1RAB9AMAPTHTTLMNA
SCHEMBL20943568 0.74 MAPT (0.32) NPC1RAB9AMAPTHTTLMNA
SCHEMBL13412683 0.72 NPC1 (0.46) NPC1RAB9AMAPTHTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3303415-B1 VISIBLE-LIGHT PHOTOINITIATORS AND USES THEREOF ALCON INC (CH) 2022-12-28 EP claimed
EP-3743270-B1 CAST-MOLDING PROCESS FOR PRODUCING UV-ABSORBING CONTACT LENSES ALCON INC (CH) 2022-06-08 EP claimed
EP-3052534-B1 METHOD FOR MAKING UV-ABSORBING OPHTHALMIC LENSES NOVARTIS AG (CH) 2019-05-01 EP claimed
EP-2564245-A1 INTRAOCULAR LENSES WITH COMBINATIONS OF UV ABSORBERS AND BLUE LIGHT CHROMOPHORES Novartis AG (CH) 2013-03-06 EP claimed
WO-2011137142-A1 INTRAOCULAR LENSES WITH COMBINATIONS OF UV ABSORBERS AND BLUE LIGHT CHROMOPHORES NOVARTIS AG (CH) 2011-11-03 WO claimed
EP-3634732-B1 METHOD FOR PRODUCING SILICONE HYDROGEL CONTACT LENSES ALCON RES LTD (US) 2021-07-21 EP disclosed
EP-2564245-A1 INTRAOCULAR LENSES WITH COMBINATIONS OF UV ABSORBERS AND BLUE LIGHT CHROMOPHORES Novartis AG (CH) 2013-03-06 EP disclosed
WO-2011137142-A1 INTRAOCULAR LENSES WITH COMBINATIONS OF UV ABSORBERS AND BLUE LIGHT CHROMOPHORES NOVARTIS AG (CH) 2011-11-03 WO disclosed