SCHEMBL10403871

SCHEMBL10403871

COCc1nnc(SC[C]=S)s1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.44
▸ KMT2A Q03164 2/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ HSD17B10 Q99714 3/20 0.34
▸ TSHR P16473 2/20 0.34
▸ ALDH1A1 P00352 6/20 0.33
▸ HPGD P15428 4/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ ALOX15 P16050 1/20 0.32
▸ RECQL P46063 1/20 0.31
▸ GAA P10253 1/20 0.31

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
SCHEMBL10401935 0.83 POLB (0.44) POLBKMT2ASMN1; SMN2HSD17B10TSHR
SCHEMBL10401934 0.77 POLB (0.52) POLBKMT2ASMN1; SMN2HSD17B10TSHR
SCHEMBL10403874 0.77 POLB (0.44) POLBKMT2ASMN1; SMN2HSD17B10TSHR
SCHEMBL19369802 0.74 POLB (0.53) POLBKMT2ASMN1; SMN2HSD17B10TSHR
SCHEMBL10403035 0.74 KMT2A (0.37) KMT2AALDH1A1
SCHEMBL10403137 0.74 KMT2A (0.37) KMT2A
SCHEMBL10401915 0.73 GAA (0.50) POLBKMT2ASMN1; SMN2ALDH1A1GAA
SCHEMBL10401989 0.72 TSHR (0.44) POLBKMT2ASMN1; SMN2HSD17B10TSHR
SCHEMBL19361775 0.70 POLB (0.48) POLBKMT2ASMN1; SMN2HSD17B10TSHR
SCHEMBL10402744 0.70 HSD17B10 (0.43) POLBKMT2ASMN1; SMN2HSD17B10TSHR

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
US-4914206-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-04-03 — — US disclosed
EP-0226896-A2 Lankacidin derivatives and production thereof Takeda Chemical Industries, Ltd. (JP) 1987-07-01 — — EP disclosed
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