SCHEMBL9213698

SCHEMBL9213698

N#Cc1c(Br)c(-c2ccc(Cl)cc2)n(C(=O)c2ccccc2)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.41
MGLL Q99685 3/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
PTGS2 P35354 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
GRIA4 P48058 2/20 0.39
GRIA2 P42262 1/20 0.39
ALDH1A1 P00352 3/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GAA P10253 2/20 0.38
KLK7 P49862 1/20 0.38
RAB9A P51151 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KLK14 Q9P0G3 1/20 0.38
KLK5 Q9Y337 1/20 0.38
ST14 Q9Y5Y6 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
SCHEMBL8404970 0.81 ABCB1 (0.37) ABCB1MGLLKMT2AMEN1PTGS2
SCHEMBL9423555 0.75 MAP3K14 (0.41) MGLLALDH1A1RAB9APOLB
SCHEMBL9218224 0.74 MEN1 (0.37) ABCB1MGLLKMT2AMEN1PTGS2
SCHEMBL8871814 0.74 MGLL (0.40) MGLLADORA2AADORA1GRIA4GRIA2
SCHEMBL9423468 0.73 KIF11 (0.38) MGLLGRIA4GRIA2ALDH1A1MAPT
SCHEMBL9211282 0.72 MAP3K14 (0.41) MGLLALDH1A1RAB9APOLB
SCHEMBL9423419 0.72 ALDH1A1 (0.38) MGLLKMT2AMEN1GRIA4GRIA2
SCHEMBL9215790 0.71 MGLL (0.42) MGLLKMT2AMEN1PTGS2ALDH1A1
SCHEMBL9208543 0.71 CACNA1H (0.36) KMT2AMEN1ADORA2AADORA1GRIA4
SCHEMBL9217898 0.70 MGLL (0.41) MGLLKMT2AMEN1GRIA4GRIA2

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-0484614-B1 N-acylated arylpyrroles useful as insecticidal, acaricidal, nematicidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1995-05-24 EP claimed
US-5328928-A Miticides, nematocides, fungicides or molluscicides AMERICAN CYANAMID COMPANY (US) 1994-07-12 US claimed
JP-7097365-A None JP disclosed
JP-H0797365-A N-ACYLATED ARYLPYRROLE USEFUL AS INSECTICIDE, ACARICIDE, NEMATOCIDE AND MOLLUSCICIDE AMERICAN CYANAMID CO 1995-04-11 JP disclosed
US-5328928-A Miticides, nematocides, fungicides or molluscicides AMERICAN CYANAMID COMPANY (US) 1994-07-12 US disclosed