SCHEMBL11367405

SCHEMBL11367405

Cc1cc2[nH]c(N)nc2cc1SSc1cc2nc(N)[nH]c2cc1C

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP6 P51161 2/20 0.70
PLAU P00749 1/20 0.43
HTR3E A5X5Y0 1/20 0.43
HTR3B O95264 1/20 0.43
HTR3A P46098 1/20 0.43
BACE1 P56817 1/20 0.43
HTR3D Q70Z44 1/20 0.43
HTR3C Q8WXA8 1/20 0.43
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 2/20 0.41
ATM Q13315 2/20 0.41
KDM4E B2RXH2 1/20 0.41
CACNA1B Q00975 1/20 0.41
APBA1 Q02410 1/20 0.41
MCL1 Q07820 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MASP2 O00187 1/20 0.40
NUDT1 P36639 1/20 0.40
AOC3 Q16853 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
SCHEMBL11367412 0.93 FABP6 (0.70) FABP6PLAUHTR3EHTR3BHTR3A
SCHEMBL393703 0.83 FABP6 (1.00) FABP6PLAUHTR3EHTR3BHTR3A
Bromide SCHEMBL23295657 0.81 FABP6 (0.96) FABP6PLAUHTR3EHTR3BHTR3A
Water SCHEMBL10985661 0.81 FABP6 (0.96) FABP6PLAUHTR3EHTR3BHTR3A
SCHEMBL11373844 0.79 FABP6 (0.50) FABP6PLAUHTR3EHTR3BHTR3A
SCHEMBL11369322 0.79 HTR3E (0.51) FABP6PLAUHTR3EHTR3BHTR3A
SCHEMBL11368576 0.79 FABP6 (0.50) FABP6PLAUHTR3EHTR3BHTR3A
SCHEMBL11365423 0.78 FABP6 (0.50) FABP6PLAUHTR3EHTR3BHTR3A
SCHEMBL5924162 0.76 FABP6 (0.72) FABP6PLAUHTR3EHTR3BHTR3A
SCHEMBL11373862 0.75 FABP6 (0.50) FABP6PLAUHTR3EHTR3BHTR3A

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
US-4259344-A FUNGICIDES, ANTHELMINTICS CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA R.T. (HU) 1981-03-31 US disclosed