SCHEMBL10927675

SCHEMBL10927675

CCCSc1nsnc(Cl)c1=O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 1/20 0.38
▸ HTT P42858 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ CHRM1 P11229 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ LMNA P02545 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL6781817 0.74 CHRM1 (0.42) CHRM1ALDH1A1
SCHEMBL12312225 0.63 HSD17B10 (0.39) SIGMAR1HTTHSD17B10CHRM1ALDH1A1
SCHEMBL8444907 0.59 CHRM1 (0.42) HTTCHRM1ALDH1A1LMNA
SCHEMBL8445611 0.59 CHRM1 (0.42) CHRM1ALDH1A1
SCHEMBL8441881 0.59 CHRM1 (0.42) HTTCHRM1ALDH1A1HPGDKMT2A
SCHEMBL11354287 0.58 ALDH1A1 (0.44) ALDH1A1LMNAHPGDKMT2A
SCHEMBL10968344 0.57 KMT2A (0.36) HTTHSD17B10ALDH1A1LMNAHPGD
SCHEMBL20668745 0.56 ALDH1A1 (0.42) ALDH1A1LMNAHPGDKMT2A
SCHEMBL13001461 0.56 — —
SCHEMBL13657574 0.56 HSD17B10 (0.54) HTTHSD17B10ALDH1A1LMNAHPGD

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-4497807-A FUNGICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-02-05 — — US disclosed
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