SCHEMBL9822341

SCHEMBL9822341

NC(=O)c1cnc2nc(CO)nn2c1S

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
POLB P06746 1/20 0.37
KDM4E B2RXH2 5/20 0.35
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.33
MAP2K1 Q02750 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
DYRK1B Q9Y463 1/20 0.33
TSHR P16473 1/20 0.31
RAB9A P51151 2/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 2/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL9822273 0.87 KDM4E (0.42) ALDH1A1POLBKDM4EMAPTKMT2A
SCHEMBL9822338 0.84 ALDH1A1 (0.36) ALDH1A1POLBKDM4EMAPTKMT2A
SCHEMBL9822014 0.83 ALDH1A1 (0.40) ALDH1A1POLBKDM4EMAPTKMT2A
SCHEMBL9822217 0.75 KDM4E (0.40) ALDH1A1POLBKDM4EMAPTKMT2A
SCHEMBL9822316 0.73 KDM4E (0.41) ALDH1A1POLBKDM4EMAPTKMT2A
SCHEMBL9822069 0.71 LMNA (0.35) ALDH1A1POLBKDM4EMAPTCLK4
SCHEMBL9822031 0.70 KDM4E (0.41) ALDH1A1POLBKDM4EMAPTKMT2A
SCHEMBL9821982 0.67 SORD (0.41) ALDH1A1POLBKDM4ERAB9ANPC1
SCHEMBL9677476 0.66 KDM4E (0.44) ALDH1A1POLBKDM4EMAPTKMT2A
SCHEMBL10407785 0.66 POLB (0.59) ALDH1A1POLBKDM4EMAPTKMT2A

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-4987129-A BACTERICIDES SANKEI PHARMACEUTICAL CO., LTD. (JP) 1991-01-22 US disclosed
US-4958019-A Intermediates for synthesis of cephalosporin compounds SANKEI PHARMACEUTICAL CO., LTD. (JP) 1990-09-18 US disclosed
US-4956462-A Bactericides, ANTIBIOTICS, CEPHALOSPORINS SANKEI PHARMACEUTICAL CO., LTD. (JP) 1990-09-11 US disclosed