SCHEMBL22201376

SCHEMBL22201376

O=S(=O)(CCO)c1ccnc2cc(-c3ccccn3)nc(Nc3ccc4nc(C5CC5)sc4c3)c12

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 5/20 0.39
P2RX3 P56373 5/20 0.38
LMNA P02545 2/20 0.34
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
STAT3 P40763 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NAAA Q02083 1/20 0.32
ALOX12 P18054 1/20 0.32
MAPT P10636 1/20 0.32
UBE2M P61081 1/20 0.31
DCUN1D1 Q96GG9 1/20 0.31

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
SCHEMBL22201563 0.88 P2RX3 (0.38) SYKP2RX3LMNA
SCHEMBL22201329 0.88 P2RX3 (0.37) SYKP2RX3LMNAMAPT
SCHEMBL22201519 0.86 SYK (0.40) SYKP2RX3LMNAALDH1A1TSHR
SCHEMBL22201305 0.84 SYK (0.44) SYKP2RX3LMNAALDH1A1SMN1; SMN2
SCHEMBL22201293 0.82 SYK (0.44) SYKP2RX3ALDH1A1ALOX12UBE2M
SCHEMBL22201302 0.82 SYK (0.44) SYKP2RX3LMNAALDH1A1SMN1; SMN2
SCHEMBL22201245 0.81 SYK (0.42) SYKP2RX3LMNAALDH1A1SMN1; SMN2
SCHEMBL22201304 0.81 SYK (0.43) SYKP2RX3LMNAALDH1A1SMN1; SMN2
SCHEMBL22201292 0.80 SYK (0.42) SYKLMNASMN1; SMN2MAPTUBE2M
SCHEMBL22201368 0.79 SYK (0.45) SYKP2RX3ALDH1A1ALOX12

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
WO-2020142748-A1 METHODS AND MATERIALS FOR INCREASING TRANSCRIPTION FACTOR EB POLYPEPTIDE LEVELS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2020-07-09 WO disclosed