SCHEMBL11083057

SCHEMBL11083057

O=C1NC(=S)SC1=Cc1ccc(C(F)(F)F)o1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.55
▸ POLB P06746 3/20 0.55
▸ HPGD P15428 3/20 0.55
▸ KMT2A Q03164 3/20 0.55
▸ L3MBTL1 Q9Y468 3/20 0.55
▸ INSR P06213 2/20 0.55
▸ IGF1R P08069 2/20 0.55
▸ LMNA P02545 2/20 0.55
▸ GAA P10253 2/20 0.55
▸ PKM P14618 2/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ MYC P01106 1/20 0.54
▸ MAX P61244 1/20 0.54
▸ PIM1 P11309 1/20 0.52
▸ CISD1 Q9NZ45 1/20 0.52
▸ PTP4A3 O75365 2/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ MAPT P10636 2/20 0.52
▸ MAPK1 P28482 2/20 0.52
▸ RECQL P46063 2/20 0.52

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
SCHEMBL11083053 1.00 MEN1 (0.55) MEN1POLBHPGDKMT2AL3MBTL1
SCHEMBL622884 0.79 INSR (0.69) INSRIGF1RMYCMAXPIM1
SCHEMBL622883 0.79 INSR (0.69) INSRIGF1RMYCMAXPIM1
SCHEMBL622882 0.79 INSR (0.69) INSRIGF1RMYCMAXPIM1
SCHEMBL8115898 0.78 MEN1 (0.65) MEN1POLBHPGDKMT2AL3MBTL1
SCHEMBL8176812 0.78 MEN1 (0.65) MEN1POLBHPGDKMT2AL3MBTL1
SCHEMBL8115897 0.78 MEN1 (0.65) MEN1POLBHPGDKMT2AL3MBTL1
SCHEMBL12297879 0.77 RXRA (0.82) MEN1POLBHPGDKMT2AL3MBTL1
SCHEMBL3904208 0.76 IGF1R (0.79) MEN1POLBHPGDKMT2AL3MBTL1
SCHEMBL3904205 0.76 IGF1R (0.79) MEN1POLBHPGDKMT2AL3MBTL1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4439443-A REDUCE HEMORRHAGE WITH MERCAPTO THIENYL ACRYLIC ACIDS OR DISULFIDES RICHARDSON-MERRELL INC. (US) 1984-03-27 — — US disclosed
US-4347255-A REDUCING HEMORRHAGE AND NECROSIS WITH ALPHA-MERCAPTO-BETA-HETERO ACRYLIC ACIDS AND DISULFIDES RICHARDSON-MERRELL INC. (US) 1982-08-31 — — US disclosed
US-4169149-A Use of α-mercapto-β-arylacrylic acid derivatives in heavy metal poisoning GIROUX EUGENE L 1979-09-25 — — US disclosed
US-4130653-A 2-MERCAPTO-3-ARYL ACRYLIC ACID MERRELL TORAUDE ET COMPAGNIE (FR) 1978-12-19 — — US disclosed
US-4124718-A ADMINISTERING A-MERCAPTO-B-ARYL-ACRYLIC ACIDS MERRELL TORAUDE ET COMPAGNIE (FR) 1978-11-07 — — US disclosed
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