SCHEMBL11500352

SCHEMBL11500352

N#C[CH]c1cc(Oc2cccc(F)c2)ccc1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.38
▸ FFAR1 O14842 1/20 0.38
▸ NFE2L2 Q16236 4/20 0.37
▸ AR P10275 2/20 0.36
▸ MMP2 P08253 1/20 0.36
▸ MMP3 P08254 1/20 0.36
▸ MMP9 P14780 1/20 0.36
▸ MMP14 P50281 1/20 0.36
▸ SLC6A2 P23975 2/20 0.35
▸ SLC6A4 P31645 2/20 0.35
▸ SLC6A3 Q01959 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HTR1A P08908 1/20 0.35
▸ MGLL Q99685 1/20 0.34
▸ CNR1 P21554 1/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ MAP4K4 O95819 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
SCHEMBL11499601 0.88 LTA4H (0.39) FFAR4FFAR1ARALDH1A1MAPT
SCHEMBL11498515 0.86 NFE2L2 (0.36) NFE2L2ARKDM4EALDH1A1HPGD
SCHEMBL11288471 0.80 FFAR4 (0.43) FFAR4FFAR1NFE2L2MMP2MMP3
SCHEMBL10546476 0.80 NFE2L2 (0.46) NFE2L2MMP2MMP3MMP9MMP14
SCHEMBL10550056 0.77 SLC6A2 (0.39) NFE2L2ARSLC6A2SLC6A4SLC6A3
SCHEMBL6289347 0.74 ALDH1A1 (0.54) FFAR4FFAR1MMP2MMP3MMP9
SCHEMBL6290496 0.74 ALDH1A1 (0.54) FFAR4FFAR1MMP2MMP3MMP9
SCHEMBL7938427 0.74 MAPT (0.46) NFE2L2MMP2MMP3MMP9MMP14
SCHEMBL921025 0.72 CYP19A1 (0.51) FFAR4FFAR1ARMMP2MMP3
SCHEMBL6290322 0.72 SMN1; SMN2 (0.58) MMP2MMP3MMP9MMP14SLC6A2

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
EP-0001566-B1 CYCLOBUTANECARBOXYLIC ACID DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS INSECTICIDES BAYER AG (DE) 1980-11-26 — — EP disclosed
EP-0001566-A2 Cyclobutanecarboxylic acid derivatives, processes for their preparation and their use as insecticides BAYER AG (DE) 1979-05-02 — — EP disclosed
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