SCHEMBL7584622

SCHEMBL7584622

O=c1ccc(-c2cc(Cl)cc(Cl)c2)n[nH]1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.58
LMNA P02545 3/20 0.55
KMT2A Q03164 2/20 0.55
MEN1 O00255 1/20 0.55
PDE4A P27815 3/20 0.50
PDE4B Q07343 3/20 0.50
PDE4C Q08493 3/20 0.50
PDE4D Q08499 3/20 0.50
PDE3B Q13370 5/20 0.47
PDE3A Q14432 5/20 0.47
MAPT P10636 1/20 0.44
HPGD P15428 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
TP53 P04637 1/20 0.42
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
CYP2C19 P33261 1/20 0.42
BLM P54132 1/20 0.42
PMP22 Q01453 1/20 0.42

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
SCHEMBL11622724 0.84 NOTUM (0.55) CYP1A2LMNAKMT2AMEN1PDE4A
SCHEMBL4048920 0.84 CYP1A2 (0.62) CYP1A2LMNAKMT2AMEN1PDE4A
SCHEMBL11742209 0.83 CYP1A2 (0.56) CYP1A2LMNAKMT2AMEN1PDE4A
SCHEMBL481916 0.82 LMNA (0.67) CYP1A2LMNAKMT2AMEN1PDE4A
Bromide SCHEMBL11739258 0.82 CYP1A2 (0.61) CYP1A2LMNAKMT2AMEN1PDE4A
SCHEMBL675134 0.82 LMNA (0.53) CYP1A2LMNAKMT2AMEN1PDE4A
SCHEMBL11369784 0.80 CYP1A2 (0.53) CYP1A2LMNAKMT2AMEN1PDE4A
SCHEMBL21550 0.80 LMNA (0.59) CYP1A2LMNAKMT2AMEN1PDE4A
SCHEMBL8889484 0.80 CYP1A2 (0.53) CYP1A2LMNAKMT2AMEN1PDE3A
SCHEMBL3452908 0.79 LMNA (0.80) CYP1A2LMNAKMT2AMEN1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0773248-B1 Polymers with heterocyclic side groups MISSISSIPPI POLYMER TECHNOLOGI (US) 2002-10-02 EP disclosed
US-5668245-A PHENYLENE POLYMERS WITH HETEROCYCLIC SIDE GROUPS MAXDEM INCORPORATED (US) 1997-09-16 US disclosed
EP-0773248-A1 Polymers with heterocyclic side groups MAXDEM INCORPORATED (US) 1997-05-14 EP disclosed