SCHEMBL10721825

SCHEMBL10721825

Brc1cccc(SCc2nc3ccccc3s2)c1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.53
▸ NPC1 O15118 4/20 0.53
▸ SMN1; SMN2 Q16637 7/20 0.51
▸ MAPT P10636 6/20 0.51
▸ TSHR P16473 2/20 0.51
▸ KMT2A Q03164 5/20 0.49
▸ ALDH1A1 P00352 4/20 0.49
▸ HPGD P15428 3/20 0.49
▸ LMNA P02545 3/20 0.49
▸ MEN1 O00255 4/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ ALOX5 P09917 1/20 0.47
▸ EPHX2 P34913 1/20 0.47
▸ UBE2T Q9NPD8 1/20 0.46
▸ ASIC3 Q9UHC3 1/20 0.46
▸ USP2 O75604 1/20 0.45
▸ HTT P42858 1/20 0.43

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
SCHEMBL10721662 0.84 RAB9A (0.57) RAB9ANPC1SMN1; SMN2MAPTTSHR
SCHEMBL27633932 0.74 PDE10A (0.50) RAB9ANPC1SMN1; SMN2KMT2AALDH1A1
SCHEMBL28124586 0.71 HTT (0.50) RAB9ANPC1SMN1; SMN2KMT2AALDH1A1
SCHEMBL226465 0.71 UBE2T (0.70) RAB9ANPC1SMN1; SMN2MAPTTSHR
SCHEMBL7697161 0.71 MAOA (0.43) RAB9AMAPTHTT
SCHEMBL13461926 0.71 RAB9A (0.62) RAB9ANPC1SMN1; SMN2MAPTTSHR
SCHEMBL9018537 0.70 UBE2T (0.54) RAB9ANPC1SMN1; SMN2MAPTTSHR
SCHEMBL752798 0.70 RAB9A (0.67) RAB9ANPC1SMN1; SMN2MAPTTSHR
SCHEMBL29407035 0.70 RAB9A (0.67) RAB9ANPC1SMN1; SMN2MAPTTSHR
Bromide SCHEMBL7601035 0.69 UBE2T (0.68) RAB9ANPC1SMN1; SMN2MAPTTSHR

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-0223368-A1 Substituted naphthalene derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1987-05-27 — — EP claimed
EP-0223368-A1 Substituted naphthalene derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1987-05-27 — — EP disclosed
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