SCHEMBL9225979

SCHEMBL9225979

CO/N=C(\C(=O)O)c1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1.[NaH]

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.59
MAPT P10636 6/20 0.59
LMNA P02545 3/20 0.59
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
NPSR1 Q6W5P4 3/20 0.40
RECQL P46063 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 2/20 0.39
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
AMY1A P0DUB6 2/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
ITGB1 P05556 2/20 0.35
ITGA4 P13612 2/20 0.35
KCNN4 O15554 1/20 0.35

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
SCHEMBL9225992 1.00 GAA (0.59) GAAMAPTLMNAMEN1KMT2A
SCHEMBL6051576 0.99 GAA (0.60) GAAMAPTLMNAMEN1KMT2A
SCHEMBL3997590 0.99 GAA (0.60) GAAMAPTLMNAMEN1KMT2A
SCHEMBL9142414 0.99 GAA (0.60) GAAMAPTLMNAMEN1KMT2A
Ammonia Solution, Strong SCHEMBL9414597 0.98 GAA (0.59) GAAMAPTLMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL5096542 0.98 GAA (0.59) GAAMAPTLMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL7776978 0.98 GAA (0.59) GAAMAPTLMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL9108028 0.98 GAA (0.59) GAAMAPTLMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL7776981 0.98 GAA (0.59) GAAMAPTLMNAMEN1KMT2A
SCHEMBL5096538 0.90 MAPT (0.52) GAAMAPTLMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0652220-A1 CEPHALOSPORIN DERIVATIVE TAISHO PHARMACEUTICAL CO. LTD (JP) 1995-05-10 EP disclosed