SCHEMBL10401966

SCHEMBL10401966

Cn1cnnc1SCC(=O)C=O

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.55
ALDH1A1 P00352 8/20 0.53
KMT2A Q03164 3/20 0.53
MAPT P10636 3/20 0.53
KDM4E B2RXH2 2/20 0.53
HSD11B1 P28845 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
HSD17B10 Q99714 1/20 0.53
GAA P10253 1/20 0.53
RAB9A P51151 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
POLB P06746 5/20 0.52
ATM Q13315 2/20 0.52
MAPK1 P28482 1/20 0.51
MEN1 O00255 1/20 0.50
LMNA P02545 1/20 0.50

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
SCHEMBL10402229 0.86 KMT2A (0.56) L3MBTL1ALDH1A1KMT2AMAPTKDM4E
SCHEMBL10401965 0.77 L3MBTL1 (0.55) L3MBTL1ALDH1A1KMT2AMAPTKDM4E
SCHEMBL10401789 0.71 L3MBTL1 (0.51) L3MBTL1ALDH1A1KMT2AMAPTKDM4E
SCHEMBL10401788 0.71 ALDH1A1 (0.50) L3MBTL1ALDH1A1KMT2AMAPTKDM4E
SCHEMBL10404174 0.70 ALDH1A1 (0.46) L3MBTL1ALDH1A1KMT2AMAPTKDM4E
SCHEMBL18026648 0.68 LMNA (0.45) L3MBTL1ALDH1A1KMT2AMAPTKDM4E
SCHEMBL4378220 0.68 ALDH1A1 (0.49) L3MBTL1ALDH1A1KMT2AMAPTKDM4E
SCHEMBL10404087 0.67 ALDH1A1 (0.46) L3MBTL1ALDH1A1KMT2AMAPTKDM4E
SCHEMBL10403031 0.67 L3MBTL1 (0.41) L3MBTL1ALDH1A1KMT2AMAPTKDM4E
SCHEMBL16363812 0.66 MAPT (0.44) L3MBTL1ALDH1A1KMT2AMAPTKDM4E

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