SCHEMBL10696656

SCHEMBL10696656

CCON=C(C(=O)Cl)c1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.46
KMT2A Q03164 7/20 0.46
MEN1 O00255 6/20 0.46
GAA P10253 5/20 0.46
NPSR1 Q6W5P4 3/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 3/20 0.46
RECQL P46063 1/20 0.46
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 4/20 0.42
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
POLB P06746 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MAPK1 P28482 1/20 0.41
MAOA P21397 2/20 0.40
MAOB P27338 2/20 0.40

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
SCHEMBL9285763 1.00 MAPT (0.46) MAPTKMT2AMEN1GAANPSR1
SCHEMBL8527292 0.91 MAPT (0.46) MAPTKMT2AMEN1GAANPSR1
SCHEMBL6051390 0.91 MAPT (0.46) MAPTKMT2AMEN1GAANPSR1
SCHEMBL6051393 0.91 MAPT (0.46) MAPTKMT2AMEN1GAANPSR1
Hydrochloric Acid SCHEMBL10696662 0.91 MAPT (0.46) MAPTKMT2AMEN1GAANPSR1
SCHEMBL11305480 0.89 KMT2A (0.46) MAPTKMT2AMEN1GAANPSR1
SCHEMBL11305476 0.89 KMT2A (0.44) MAPTKMT2AMEN1GAANPSR1
SCHEMBL11305477 0.89 KMT2A (0.44) MAPTKMT2AMEN1GAANPSR1
SCHEMBL9345522 0.88 KMT2A (0.55) MAPTKMT2AMEN1GAANPSR1
SCHEMBL9345517 0.88 KMT2A (0.55) MAPTKMT2AMEN1GAANPSR1

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-0272827-A2 3-Heterocyclicthiomethyl cephalosphorins ZENECA Pharma S.A. (FR) 1988-06-29 EP disclosed