SCHEMBL28791708

SCHEMBL28791708

Brc1cccc(-c2c[nH]c(CCc3ccccc3)n2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ HTT P42858 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ LMNA P02545 1/20 0.45
▸ GSK3B P49841 1/20 0.42
▸ RAB9A P51151 4/20 0.41
▸ NPC1 O15118 3/20 0.41
▸ IDO1 P14902 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ METAP2 P50579 1/20 0.41
▸ MGAM O43451 2/20 0.40
▸ GAA P10253 2/20 0.40
▸ SI P14410 2/20 0.40
▸ MGAM2 Q2M2H8 2/20 0.40
▸ HK1 P19367 1/20 0.40
▸ HKDC1 Q2TB90 1/20 0.40

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
SCHEMBL12068347 0.86 GSK3B (0.49) MAPTSMN1; SMN2MEN1KMT2AGSK3B
SCHEMBL27815155 0.85 GSK3B (0.44) MAPTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL2870026 0.83 ADORA2A (0.45) MAPTSMN1; SMN2MEN1HTTKMT2A
SCHEMBL27834601 0.83 CXCR2 (0.47) MAPTHTTGSK3BIDO1ALDH1A1
SCHEMBL27967836 0.81 GSK3B (0.38) MAPTSMN1; SMN2KMT2AGSK3BRAB9A
SCHEMBL27967980 0.81 GSK3B (0.38) MAPTSMN1; SMN2GSK3BRAB9ANPC1
SCHEMBL10273880 0.79 IDO1 (0.45) MAPTSMN1; SMN2MEN1HTTKMT2A
SCHEMBL27967690 0.78 CXCR2 (0.44) MAPTSMN1; SMN2GSK3BRAB9ANPC1
SCHEMBL26111295 0.78 GAA (0.43) MAPTSMN1; SMN2MEN1HTTKMT2A
SCHEMBL4822610 0.77 GSK3B (0.51) GSK3BPDE10A

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
CN-102119240-B Surface treating agent for copper or copper alloy and use thereof SHIKOKU CHEM 2014-07-30 — — CN disclosed
CN-102119240-A Surface treating agent for copper or copper alloy and use thereof SHIKOKU CHEM 2011-07-06 — — CN disclosed
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