SCHEMBL9019189

SCHEMBL9019189

O=C(O)c1cc(-c2ccc(Cl)cc2)n(O)c1C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
KDM1A O60341 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
RPA1 P27694 2/20 0.40
MARS1 P56192 1/20 0.39
ATM Q13315 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GLO1 Q04760 1/20 0.39
LDHA P00338 1/20 0.39
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 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
SCHEMBL9019037 0.81 NPC1 (0.42) MEN1KMT2ANPC1RAB9AKDM1A
SCHEMBL9019246 0.78 NPC1 (0.46) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL2063655 0.69 NPC1 (0.61) NPC1RAB9AKDM1ASMN1; SMN2MAPT
SCHEMBL2215605 0.68 NOTUM (0.53) NPC1RAB9ASMN1; SMN2RPA1ALDH1A1
SCHEMBL23354390 0.67 PTGDR2 (0.59) MEN1KMT2AKDM1AALDH1A1
SCHEMBL8415325 0.67 MAPK14 (0.56) MEN1KMT2ANPC1RAB9AKDM1A
SCHEMBL29978935 0.67 PTGDR2 (0.59) MEN1KMT2AKDM1AALDH1A1
SCHEMBL8798669 0.66 KDM4E (0.38) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL16403258 0.66 NOTUM (0.70) NPC1RAB9AALDH1A1
SCHEMBL427243 0.65 SMN1; SMN2 (0.59) MEN1KMT2ARAB9ASMN1; SMN2MAPT

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
EP-0434940-B1 N-oxygenated arylpyrrole, insecticidal, acaricidal and nematicidal agents AMERICAN CYANAMID CO (US) 1996-05-29 EP disclosed
US-5399716-A N-oxygenated arylpyrrole insecticidal, acaricidal and nematicidal agents AMERICAN CYANAMID COMPANY (US) 1995-03-21 US disclosed
US-5347016-A N-oxygenated arylpyrrole intermediates for insecticidal, acaricidal and nematicidal agents AMERICAN CYANAMID COMPANY (US) 1994-09-13 US disclosed
US-5232979-A Insecticides, miticides, nematocides AMERICAN CYANAMID COMPANY (US) 1993-08-03 US disclosed
US-5102904-A N-OXYGENATED ARYLPYRROLE INSECTICIDAL, ACARICIDAL AND NEMATICIDAL AGENTS AND USE THEREAS AMERICAN CYANAMID COMPANY (US) 1992-04-07 US disclosed