SCHEMBL16451464

SCHEMBL16451464

Cc1cccc(Oc2ccc(C(C)(C)c3ccc(Oc4cccc(N)c4)cc3)cc2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.66
▸ MAOB P27338 1/20 0.54
▸ MAPT P10636 4/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ GAA P10253 2/20 0.47
▸ MITF O75030 1/20 0.47
▸ GFER P55789 1/20 0.47
▸ NLRP1 Q9C000 1/20 0.47
▸ NOD2 Q9HC29 1/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ HTT P42858 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ NPC1 O15118 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ CYP3A4 P08684 1/20 0.43
▸ ATM Q13315 1/20 0.42

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
SCHEMBL30853973 0.92 MAOB (0.63) ALDH1A1MAOBMAPTMEN1KMT2A
SCHEMBL29374472 0.92 MAOB (0.63) ALDH1A1MAOBMAPTMEN1KMT2A
SCHEMBL202158 0.92 MAOB (0.63) ALDH1A1MAOBMAPTMEN1KMT2A
SCHEMBL125626 0.92 MAOB (0.63) ALDH1A1MAOBMAPTMEN1KMT2A
SCHEMBL29492480 0.92 MAOB (0.63) ALDH1A1MAOBMAPTMEN1KMT2A
Benzene SCHEMBL9083189 0.91 MAOB (0.67) ALDH1A1MAOBMAPTMEN1KMT2A
SCHEMBL12755245 0.91 ALDH1A1 (0.62) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL3465746 0.89 ALDH1A1 (0.61) ALDH1A1MAOBMAPTMEN1KMT2A
SCHEMBL3647253 0.88 MAOB (0.68) ALDH1A1MAOBMAPTMEN1KMT2A
SCHEMBL16438739 0.88 MAOB (0.58) ALDH1A1MAOBMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9938372-B2 Formulation methodology for distortional thermosets THE BOEING COMPANY (US) 2018-04-10 — — US disclosed
US-20170101503-A1 FORMULATION METHODOLOGY FOR DISTORTIONAL THERMOSETS THE BOEING COMPANY 2017-04-13 — — US disclosed
US-20160194437-A1 NEW FORMULATION METHODOLOGY FOR DISTORTIONAL THERMOSETS THE BOEING COMPANY 2016-07-07 — — US disclosed
US-9309353-B2 Formulation methodology for distortional thermosets THE BOEING COMPANY (US) 2016-04-12 — — US disclosed
US-20150045505-A1 NEW FORMULATION METHODOLOGY FOR DISTORTIONAL THERMOSETS THE BOEING COMPANY 2015-02-12 — — US disclosed
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