SCHEMBL16952367

SCHEMBL16952367

[CH2]C(C=C)c1cc(C#N)ccc1OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 5/20 0.44
▸ IMPDH2 P12268 1/20 0.40
▸ IMPDH1 P20839 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ KDM1A O60341 2/20 0.38
▸ SLC6A4 P31645 1/20 0.37
▸ GUSB P08236 1/20 0.36
▸ ESRRA P11474 1/20 0.36
▸ CYP11B1 P15538 1/20 0.36
▸ CYP11B2 P19099 1/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ MCL1 Q07820 1/20 0.34
▸ P4HB P07237 1/20 0.34
▸ ALPL P05186 1/20 0.34
▸ CTSA P10619 1/20 0.34
▸ PDE4A P27815 1/20 0.34
▸ PDE4B Q07343 1/20 0.34

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
SCHEMBL16959915 0.84 TRPV4 (0.47) ARUSP2ALDH1A1MEN1KMT2A
SCHEMBL16961573 0.84 XDH (0.38) AR
SCHEMBL16955918 0.83 AR (0.46) ARKDM4EUSP2ALDH1A1KDM1A
SCHEMBL523615 0.80 AR (0.49) ARIMPDH2IMPDH1KDM4EUSP2
SCHEMBL16962581 0.78 AR (0.42) ARKDM4EUSP2ALDH1A1KDM1A
SCHEMBL16959497 0.78 CYP2A6 (0.38) ARIMPDH2IMPDH1ALDH1A1CYP11B1
SCHEMBL16955354 0.78 AMY1A (0.38) KDM4EALDH1A1
SCHEMBL17731548 0.78 AR (0.47) ARIMPDH2IMPDH1KDM4EUSP2
SCHEMBL17731549 0.78 AR (0.47) ARIMPDH2IMPDH1KDM4EUSP2
SCHEMBL18145874 0.78 AR (0.40) ARALDH1A1KDM1ASLC6A4GUSB

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
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 — — EP disclosed
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