SCHEMBL8580779

SCHEMBL8580779

Nc1ccc(OC(Oc2ccc(N)cc2)(Oc2ccc(N)cc2)Oc2ccc(N)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.55
TDP1 Q9NUW8 6/20 0.55
CYP3A4 P08684 3/20 0.55
TSHR P16473 2/20 0.55
MAPK1 P28482 2/20 0.50
MAPT P10636 7/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MAOA P21397 3/20 0.46
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
HPGD P15428 1/20 0.44
MAOB P27338 2/20 0.44
TEAD4 Q15561 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.42
GAA P10253 2/20 0.42
POLB P06746 1/20 0.42
MITF O75030 1/20 0.42
GFER P55789 1/20 0.42
NLRP1 Q9C000 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
SCHEMBL18771119 0.88 TEAD4 (0.64) ALDH1A1TDP1CYP3A4TSHRMAPK1
SCHEMBL5073 0.78 TDP1 (0.50) ALDH1A1TDP1CYP3A4TSHRMAPK1
SCHEMBL292991 0.78 TDP1 (0.52) ALDH1A1TDP1CYP3A4TSHRMAPK1
SCHEMBL11164498 0.78 TDP1 (0.52) ALDH1A1TDP1CYP3A4TSHRMAPK1
SCHEMBL1470582 0.78 TDP1 (0.52) ALDH1A1TDP1CYP3A4TSHRMAPK1
SCHEMBL9635559 0.76 ALDH1A1 (0.48) ALDH1A1TDP1CYP3A4TSHRMAPK1
Hydrochloric Acid SCHEMBL8756363 0.76 TDP1 (0.48) ALDH1A1TDP1CYP3A4TSHRMAPK1
Hydrochloric Acid SCHEMBL3785323 0.76 TDP1 (0.48) ALDH1A1TDP1CYP3A4TSHRMAPK1
SCHEMBL20653261 0.74 ALDH1A1 (0.48) ALDH1A1TDP1CYP3A4TSHRMAPK1
SCHEMBL20505766 0.74 ALDH1A1 (0.54) ALDH1A1TDP1CYP3A4TSHRMAPK1

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
US-9631049-B2 Agents for reworkable epoxy resins CONNORA TECHNOLOGIES, INC. (US) 2017-04-25 US disclosed
US-9631049-B2 Agents for reworkable epoxy resins CONNORA TECHNOLOGIES, INC. (US) 2017-04-25 US disclosed
US-20130245204-A1 NOVEL AGENTS FOR REWORKABLE EPOXY RESINS CONNORA TECHNOLOGIES, INC. (US) 2013-09-19 US disclosed
US-20130245204-A1 NOVEL AGENTS FOR REWORKABLE EPOXY RESINS CONNORA TECHNOLOGIES, INC. (US) 2013-09-19 US disclosed
WO-1998025888-A1 PROCESS FOR PREPARING ISOCYANATES FROM PRIMARY AMINES WHICH ARE NOT READILY DISSOLVED BAYER AKTIENGESELLSCHAFT (DE) 1998-06-18 WO disclosed
EP-0024816-B1 6-OXY-2,2,4-TRIALKYL-1,2-DIHYDROQUINOLINE DERIVATIVES AND DIENE RUBBER COMPOSITIONS CONTAINING THEM MONSANTO COMPANY (US) 1983-02-23 EP disclosed
EP-0024816-A1 6-Oxy-2,2,4-trialkyl-1,2-dihydroquinoline derivatives and diene rubber compositions containing them MONSANTO COMPANY (US) 1981-03-11 EP disclosed
US-4244864-A OZONE RESISTANCE MONSANTO COMPANY (US) 1981-01-13 US disclosed