SCHEMBL8923648

SCHEMBL8923648

O=C(O)c1ccccc1Sc1nncs1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.49
PKM P14618 1/20 0.46
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
PRNP P04156 2/20 0.43
RAB9A P51151 1/20 0.43
CYP1A2 P05177 1/20 0.42
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
HPGD P15428 1/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
APOBEC3A P31941 1/20 0.40
APOBEC3G Q9HC16 1/20 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
SCHEMBL6650786 0.86 SIRT1 (0.53) ALDH1A1KDM4EL3MBTL1HPGDMAPK1
SCHEMBL1482567 0.75 POLB (0.74) POLBPKMCA12CA1CA2
SCHEMBL29888792 0.75 POLB (0.74) POLBPKMCA12CA1CA2
SCHEMBL1581304 0.74 POLB (0.47) POLBPKMCA12CA1CA2
SCHEMBL9460748 0.73 POLB (0.71) POLBPKMCA12CA1CA2
SCHEMBL231042 0.70 SIRT1 (0.71) POLBPKMCA12CA1CA2
SCHEMBL14891741 0.70 FLT3 (0.47) POLBCA12CA1CA2CA4
SCHEMBL10830149 0.70 NPC1 (0.61) POLBRAB9ACYP1A2ALDH1A1TDP1
SCHEMBL126695 0.69 POLB (0.59) POLBPKMCA12CA1CA2
SCHEMBL11614461 0.69 RAB9A (0.49) POLBCA12CA1CA2CA4

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
US-5665830-A POLYOXYETHYLENE OXIDE HERCULES INCORPORATED (US) 1997-09-09 US disclosed