SCHEMBL17459350

SCHEMBL17459350

O=C(/C=C/c1cc(Cl)ccc1O)c1ccc(Cl)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.71
▸ MAPK1 P28482 1/20 0.71
▸ CXCL12 P48061 3/20 0.65
▸ DHODH Q02127 1/20 0.58
▸ GABRA3 P34903 1/20 0.57
▸ GABRA2 P47869 1/20 0.57
▸ GABRB2 P47870 1/20 0.57
▸ AR P10275 1/20 0.57
▸ MAOB P27338 2/20 0.57
▸ CXCR4 P61073 1/20 0.56
▸ CYP1B1 Q16678 1/20 0.54
▸ ERN1 O75460 1/20 0.53
▸ CHRNA7 P36544 1/20 0.53
▸ LMNA P02545 3/20 0.52
▸ HPGD P15428 2/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ CYP1A2 P05177 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52

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
SCHEMBL21647133 0.90 MAPT (0.68) MAPTMAPK1CXCL12DHODHGABRA3
SCHEMBL21647132 0.90 MAPT (0.68) MAPTMAPK1CXCL12DHODHGABRA3
SCHEMBL29837067 0.83 MAPT (1.00) MAPTMAPK1CXCL12ARMAOB
SCHEMBL17459328 0.83 MAPT (1.00) MAPTMAPK1CXCL12ARMAOB
SCHEMBL21647111 0.83 MAPT (1.00) MAPTMAPK1CXCL12ARMAOB
SCHEMBL1225557 0.81 LMNA (0.65) MAPTMAPK1CXCL12MAOBCYP1B1
SCHEMBL1225556 0.81 LMNA (0.65) MAPTMAPK1CXCL12MAOBCYP1B1
SCHEMBL30383707 0.81 MAPT (0.59) MAPTMAPK1CXCL12DHODHMAOB
SCHEMBL1225024 0.81 MAPT (0.59) MAPTMAPK1CXCL12DHODHMAOB
SCHEMBL1225026 0.81 MAPT (0.59) MAPTMAPK1CXCL12DHODHMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016012333-A1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-01-28 — — WO disclosed
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