SCHEMBL12438370

SCHEMBL12438370

Cc1cc(N)cc(C(=O)NC(C)C)c1NC(=O)c1cc(Br)nn1-c1ncccc1Cl

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.42
PDE4A P27815 3/20 0.36
MALT1 Q9UDY8 1/20 0.33
ALOX5 P09917 1/20 0.33
KCNH2 Q12809 1/20 0.33
CAPN1 P07384 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
EIF2S1 P05198 3/20 0.32
CHRNA7 P36544 2/20 0.32
EIF2AK3 Q9NZJ5 2/20 0.32
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
CNR1 P21554 1/20 0.31

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
SCHEMBL11888055 0.91 HPGD (0.35) DHODHPDE4AMALT1ALOX5CAPN1
SCHEMBL13242831 0.91 DHODH (0.35) DHODHPDE4AMALT1ALOX5KCNH2
SCHEMBL782222 0.91 DHODH (0.43) DHODHPDE4AMALT1KCNH2CAPN1
SCHEMBL782232 0.91 DHODH (0.43) DHODHPDE4AMALT1KCNH2CAPN1
SCHEMBL14361041 0.91 DHODH (0.43) DHODHPDE4AMALT1KCNH2CAPN1
SCHEMBL13287802 0.91 DHODH (0.43) DHODHMALT1CHRNA7
SCHEMBL10028768 0.90 DHODH (0.43) DHODHPDE4AMALT1KCNH2CAPN1
SCHEMBL3086322 0.89 DHODH (0.49) DHODHPDE4AMALT1KCNH2CAPN1
SCHEMBL30078383 0.88 DHODH (0.41) DHODHPDE4AMALT1KCNH2CAPN1
SCHEMBL563173 0.88 DHODH (0.41) DHODHPDE4AMALT1KCNH2CAPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120245026-A1 SPIRO FUSED 1-AMINO - PIPERDINE PYRROLIDINE DIONE DERIVATIVES WITH PESTICIDAL ACTIVITY SYNGENTA CROP PROTECTION LLC (US) 2012-09-27 US disclosed
WO-2011095462-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2011-08-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120245026-A1 SPIRO FUSED 1-AMINO - PIPERDINE PYRROLIDINE DIONE DERIVATIVES WITH PESTICIDAL ACTIVITY DDT, CAT, AQP1 DHODH 211/4885PDE4A 382/4885MALT1 3815/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.