SCHEMBL28823253

SCHEMBL28823253

Oc1ccc(-c2ccccc2-c2ccccc2)cc1.[NaH]

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 2/20 0.70
MMP3 P08254 1/20 0.70
ABL1 P00519 2/20 0.67
ABCB1 P08183 2/20 0.67
BCR P11274 2/20 0.67
ALDH1A1 P00352 1/20 0.56
HPGD P15428 1/20 0.56
HSD17B10 Q99714 1/20 0.56
ALOX5 P09917 1/20 0.56
ESR2 Q92731 3/20 0.54
BACE1 P56817 1/20 0.52
RPS6KA3 P51812 2/20 0.52
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
ESR1 P03372 2/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
GLA P06280 1/20 0.50
CA3 P07451 1/20 0.50

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
SCHEMBL29926196 0.97 BCL2L1 (0.74) BCL2L1MMP3ABL1ABCB1BCR
SCHEMBL3681823 0.97 BCL2L1 (0.74) BCL2L1MMP3ABL1ABCB1BCR
Methane SCHEMBL27552481 0.95 BCL2L1 (0.70) BCL2L1MMP3ABL1ABCB1BCR
Hydrogen Sulfide SCHEMBL27798329 0.95 BCL2L1 (0.70) BCL2L1MMP3ABL1ABCB1BCR
SCHEMBL4432976 0.92 ABL1 (0.76) BCL2L1MMP3ABL1ABCB1BCR
SCHEMBL1649339 0.92 ABL1 (0.76) BCL2L1MMP3ABL1ABCB1BCR
Phenol SCHEMBL27719443 0.89 CA12 (0.65) BCL2L1MMP3ABL1ABCB1BCR
SCHEMBL1885427 0.89 ABL1 (0.73) BCL2L1MMP3ABL1ABCB1BCR
Ethane SCHEMBL28019198 0.86 ABL1 (0.70) BCL2L1MMP3ABL1ABCB1BCR
2-Phenylphenol SCHEMBL5317663 0.86 BCL2L1 (0.74) BCL2L1MMP3ABL1ABCB1BCR

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
CN-105050394-A Pesticidal compositions in the form of aqueous suspensions MEIJI SEIKA PHARMA CO LTD 2015-11-11 CN disclosed