SCHEMBL8981978

SCHEMBL8981978

COc1ccc(Cl)cc1C(=O)NCCCc1ccc(CC2SC(=O)NC2=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DNMT3A Q9Y6K1 1/20 0.57
▸ HDAC1 Q13547 2/20 0.53
▸ HDAC6 Q9UBN7 2/20 0.53
▸ NLRP3 Q96P20 3/20 0.52
▸ LMNA P02545 1/20 0.48

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
SCHEMBL8981980 1.00 DNMT3A (0.57) DNMT3AHDAC1HDAC6NLRP3LMNA
SCHEMBL8981982 1.00 DNMT3A (0.57) DNMT3AHDAC1HDAC6NLRP3LMNA
SCHEMBL8981902 0.94 DNMT3A (0.64) DNMT3AHDAC1HDAC6NLRP3
SCHEMBL8981845 0.89 LMNA (0.52) DNMT3AHDAC1HDAC6NLRP3LMNA
SCHEMBL8981831 0.89 LMNA (0.52) DNMT3AHDAC1HDAC6NLRP3LMNA
SCHEMBL8981839 0.89 LMNA (0.52) DNMT3AHDAC1HDAC6NLRP3LMNA
SCHEMBL8458179 0.88 KMT2A (0.55) DNMT3AHDAC1HDAC6NLRP3LMNA
SCHEMBL8981741 0.86 LMNA (0.49) DNMT3AHDAC1HDAC6NLRP3LMNA
SCHEMBL8981737 0.86 LMNA (0.49) DNMT3AHDAC1HDAC6NLRP3LMNA
SCHEMBL8981731 0.86 LMNA (0.49) DNMT3AHDAC1HDAC6NLRP3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5478853-A Antidiabetic agents ADIR ET COMPAGNIE (FR) 1995-12-26 — — US claimed
US-5506245-A TREATMENT OF INSULIN-RESISTANT AND/OR NON INSULIN-DEPENDENT DIABETES ADIR ET COMPAGNIE (FR) 1996-04-09 — — US disclosed
US-5478853-A Antidiabetic agents ADIR ET COMPAGNIE (FR) 1995-12-26 — — US disclosed
Send feedback