SCHEMBL2222265

SCHEMBL2222265

COC(=O)C(OC)Oc1ccc2ccc(Br)cc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCEH1 Q6PIU2 2/20 0.47
LMNA P02545 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
FLT3 P36888 1/20 0.41
RXFP1 Q9HBX9 3/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
MAPT P10636 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ATM Q13315 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
RECQL P46063 1/20 0.39
PPARG P37231 2/20 0.39
PPARD Q03181 2/20 0.39
PPARA Q07869 2/20 0.39
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
MCL1 Q07820 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
SCHEMBL2221493 0.87 NCEH1 (0.48) NCEH1LMNAL3MBTL1FLT3RXFP1
SCHEMBL2223783 0.82 RECQL (0.39) L3MBTL1TDP1RECQLPPARGPPARD
SCHEMBL2225298 0.80 LMNA (0.48) NCEH1LMNAL3MBTL1FLT3RXFP1
SCHEMBL3616021 0.80 ALDH1A1 (0.45) KMT2ANPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL2221886 0.78 LMNA (0.38) NCEH1LMNAL3MBTL1FLT3RXFP1
SCHEMBL2221599 0.77 HSD11B1 (0.44) LMNAL3MBTL1KMT2AMEN1ATM
SCHEMBL2221330 0.75 PPARG (0.36) L3MBTL1TDP1RECQLPPARGPPARD
SCHEMBL27273683 0.74 TDP1 (0.54) NCEH1LMNAL3MBTL1RXFP1MAPT
SCHEMBL27273681 0.72 L3MBTL1 (0.49) NCEH1LMNAL3MBTL1KMT2AMEN1
SCHEMBL3138744 0.71 CYP2A6 (0.61) NCEH1LMNAL3MBTL1FLT3RXFP1

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
US-20120283216-A1 FUNGICIDAL 2-(BICYCLIC ARYLOXY)CARBOXAMIDES E. I. DU PONT DE NEMOURS AND COMPANY 2012-11-08 US disclosed
EP-2516385-A2 FUNGICIDAL 2-(BICYCLIC ARYLOXY)CARBOXAMIDES E. I. du Pont de Nemours and Company (US) 2012-10-31 EP disclosed
WO-2012087372-A1 FUNGICIDAL 2-(BICYCLIC ARYLOXY)CARBOXAMIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-06-28 WO disclosed
WO-2011087837-A9 FUNGICIDAL 2-(BICYCLIC ARYLOXY)CARBOXAMIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-09-09 WO disclosed
WO-2011087837-A2 FUNGICIDAL 2-(BICYCLIC ARYLOXY)CARBOXAMIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-07-21 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-20120283216-A1 FUNGICIDAL 2-(BICYCLIC ARYLOXY)CARBOXAMIDES CBR3, CBR1, Q6ZSR9 NCEH1 271/4885LMNA 4018/4885L3MBTL1 861/4885

“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.