SCHEMBL9019065

SCHEMBL9019065

COn1c(-c2ccc(Cl)c(Cl)c2)cc(C(=O)O)c1C#N

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RPA1 P27694 2/20 0.41
EIF4E P06730 6/20 0.40
KMO O15229 4/20 0.40
AKR1C2 P52895 2/20 0.38
AKR1C1 Q04828 2/20 0.38
PPP1CA P62136 2/20 0.38
NOTUM Q6P988 3/20 0.37

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
SCHEMBL9702708 0.82 RPA1 (0.44) RPA1EIF4EKMOPPP1CANOTUM
SCHEMBL9019127 0.69 MAOB (0.43) KMO
SCHEMBL9019069 0.66 ALDH1A1 (0.46)
SCHEMBL9019068 0.64 MAPT (0.38) KMO
SCHEMBL9019037 0.64 NPC1 (0.42) RPA1PPP1CANOTUM
SCHEMBL9316754 0.63 AHR (0.38) RPA1EIF4EKMONOTUM
SCHEMBL9019071 0.62 MAOB (0.39) KMO
SCHEMBL10834339 0.62 RPA1 (0.49) RPA1NOTUM
SCHEMBL2225438 0.62 ALDH1A1 (0.57) RPA1EIF4EAKR1C2AKR1C1
SCHEMBL2637495 0.61 TSHR (0.69) RPA1KMO

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
EP-0434940-A2 N-oxygenated arylpyrrole, insecticidal, acaricidal and nematicidal agents AMERICAN CYANAMID COMPANY (US) 1991-07-03 EP disclosed