SCHEMBL11079229

SCHEMBL11079229

NC(=O)NN(C(=O)c1ccccc1)c1ccccn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
THRB P10828 1/20 0.43
TP53 P04637 3/20 0.41
RAB9A P51151 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 4/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 3/20 0.39
PKM P14618 2/20 0.39
HSD17B10 Q99714 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
MITF O75030 1/20 0.38
CDK5 Q00535 1/20 0.38
CDK5R1 Q15078 1/20 0.38

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
SCHEMBL10382948 0.81 ALDH1A1 (0.41) TSHRRAB9AALDH1A1KMT2AMEN1
SCHEMBL10384782 0.78 OPRM1 (0.40) TSHRALDH1A1KMT2AMEN1HSD17B10
SCHEMBL10618369 0.76 TSHR (0.55) TSHRL3MBTL1TDP1THRBTP53
SCHEMBL10383421 0.75 HDAC1 (0.39) TSHRTP53RAB9AALDH1A1KMT2A
SCHEMBL4581875 0.75 TSHR (0.40) TSHRL3MBTL1TDP1RAB9ASMN1; SMN2
SCHEMBL8284019 0.74 TSHR (0.53) TSHRL3MBTL1TDP1THRBTP53
SCHEMBL17675195 0.74 TSHR (0.59) TSHRL3MBTL1THRBTP53RAB9A
SCHEMBL5225088 0.74 TSHR (0.59) TSHRL3MBTL1THRBTP53RAB9A
SCHEMBL11610217 0.73 TSHR (0.41) TSHRL3MBTL1TDP1ALDH1A1
SCHEMBL10382984 0.73 HDAC6 (0.40) SMN1; SMN2KMT2AMEN1HSD17B10HTT

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-4451653-A INSECTICIDCES THE DOW CHEMICAL COMPANY (US) 1984-05-29 US disclosed
US-4433148-A CHEMICAL INTERMEDIATES FOR TRIAZOLYL PHOSPHORUS INSECTICIDWS THE DOW CHEMICAL CO. (US) 1984-02-21 US disclosed
US-4400516-A PYRIDINE OR QUINOLINE SUBSTITUTED PESTICIDES THE DOW CHEMICAL CO. (US) 1983-08-23 US disclosed
US-4357327-A Heterocyclic substituted triazolyl phosphorous compounds and their use as insecticides THE DOW CHEMICAL CO. (US) 1982-11-02 US disclosed
US-4357328-A Heterocyclic substituted triazolyl phosphorous compounds and their use as insecticides THE DOW CHEMICAL CO. (US) 1982-11-02 US disclosed
EP-0010891-B1 HETEROCYCLIC SUBSTITUTED TRIAZOLYL PHOSPHOROUS COMPOUNDS, INSECTICIDAL COMPOSITIONS CONTAINING THEM AND METHOD FOR CONTROLLING INSECTS THE DOW CHEMICAL COMPANY (US) 1982-09-01 EP disclosed
US-4298602-A MITICIDES THE DOW CHEMICAL COMPANY (US) 1981-11-03 US disclosed
EP-0010891-A1 Heterocyclic substituted triazolyl phosphorous compounds, insecticidal compositions containing them and method for controlling insects THE DOW CHEMICAL COMPANY (US) 1980-05-14 EP disclosed