SCHEMBL9325908

SCHEMBL9325908

Nc1ccc(Oc2ccc(C(F)(F)F)cc2Cl)cc1F

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
RAB9A P51151 1/20 0.50
MEN1 O00255 1/20 0.49
TTR P02766 1/20 0.49
PPOX P50336 1/20 0.49
KMT2A Q03164 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
ATM Q13315 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HTR2A P28223 5/20 0.45
SLC6A4 P31645 5/20 0.45
KCNH2 Q12809 5/20 0.45
MRGPRX4 Q96LA9 2/20 0.44
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
EPAS1 Q99814 1/20 0.39

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
SCHEMBL31499164 1.00 FFAR1 (0.50) FFAR1L3MBTL1RAB9AMEN1TTR
SCHEMBL31499165 0.89 HTR2A (0.48) FFAR1L3MBTL1RAB9AMEN1TTR
SCHEMBL10605270 0.88 L3MBTL1 (0.52) FFAR1L3MBTL1RAB9AMEN1TTR
SCHEMBL8812673 0.85 L3MBTL1 (0.52) FFAR1L3MBTL1RAB9AMEN1TTR
SCHEMBL9373448 0.84 L3MBTL1 (0.52) FFAR1L3MBTL1RAB9AMEN1TTR
SCHEMBL10838585 0.83 L3MBTL1 (0.58) FFAR1L3MBTL1RAB9AMEN1TTR
SCHEMBL11095176 0.83 FFAR1 (0.65) FFAR1L3MBTL1RAB9AMEN1TTR
SCHEMBL13295195 0.82 PDE7A (0.49) MEN1KMT2AMAPTLMNAHTR2A
SCHEMBL11018978 0.82 ALDH1A1 (0.50) MEN1KMT2AMAPTLMNAHTR2A
SCHEMBL9582439 0.82 FFAR1 (0.58) FFAR1L3MBTL1RAB9AMEN1TTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0375069-B1 Benzamide compounds, their preparation and their use as pesticides SHELL INT RESEARCH (NL) 1994-03-09 EP disclosed
EP-0216423-B1 PESTICIDAL BENZOYLUREA COMPOUNDS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1993-05-12 EP disclosed
US-5155135-A Insecticides, miticides SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ, B.V. (NL) 1992-10-13 US disclosed
EP-0393789-A1 A process for the preparation of carbamates SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1990-10-24 EP disclosed
EP-0375069-A1 Benzamide compounds, their preparation and their use as pesticides SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1990-06-27 EP disclosed
EP-0360748-A1 Benzoylphenylureas CIBA-GEIGY AG (CH) 1990-03-28 EP disclosed
EP-0357097-A1 Benzoylthiourea compounds SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1990-03-07 EP disclosed
US-4873327-A Pesticidal benzoylurea compounds E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-10-10 US disclosed
EP-0161019-B1 PESTICIDAL BENZOYLUREA COMPOUNDS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1989-01-25 EP disclosed
US-4745113-A MITICIDES, INSECTICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-05-17 US disclosed
US-4698365-A INSECTICIDES AND MITICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-10-06 US disclosed
US-4672139-A CHEMICAL INTERMEDIATE FOR PREPARATION OF INSECTICIDE, ACARICIDE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-06-09 US disclosed
EP-0216423-A2 Pesticidal benzoylurea compounds SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1987-04-01 EP disclosed
US-4623658-A INSECTICIDES, MITICIDES SHELL OIL COMPANY (US) 1986-11-18 US disclosed