SCHEMBL31069463

SCHEMBL31069463

O=c1[nH]c(-c2cn[nH]c2)nc2ccsc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.62
RAB9A P51151 2/20 0.62
MAPT P10636 2/20 0.61
ADORA2A P29274 1/20 0.50
ADORA1 P30542 1/20 0.50
SPR P35270 4/20 0.49
PDE5A O76074 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
PDPK1 O15530 1/20 0.40
PARP1 P09874 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ROCK2 O75116 2/20 0.39
APOBEC3G Q9HC16 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL13789403 0.77 SMN1; SMN2 (0.74) SMN1; SMN2RAB9AMAPTSPRPDE5A
SCHEMBL13789318 0.77 SMN1; SMN2 (0.74) SMN1; SMN2RAB9AMAPTSPRPDE5A
SCHEMBL13789308 0.77 SMN1; SMN2 (0.74) SMN1; SMN2RAB9AMAPTSPRPDE5A
SCHEMBL30004904 0.76 MAPT (1.00) SMN1; SMN2RAB9AMAPTSPRPDE5A
SCHEMBL20303285 0.76 MAPT (1.00) SMN1; SMN2RAB9AMAPTSPRPDE5A
Hydrochloric Acid SCHEMBL20303302 0.75 SMN1; SMN2 (0.72) SMN1; SMN2RAB9AMAPTSPRPDE5A
SCHEMBL13789436 0.74 SMN1; SMN2 (0.62) SMN1; SMN2RAB9AMAPTSPRPDE5A
SCHEMBL8267253 0.72 RAB9A (0.71) SMN1; SMN2RAB9AMAPTSPRPDE5A
SCHEMBL13789402 0.72 SMN1; SMN2 (0.59) SMN1; SMN2RAB9AMAPTSPRPDE5A
SCHEMBL13789401 0.72 SMN1; SMN2 (0.59) SMN1; SMN2RAB9AMAPTSPRPDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240252688-A1 COMPOSITIONS AND METHODS FOR ENHANCED PROTEIN PRODUCTION HDT BIO CORP. 2024-08-01 US claimed
US-20240252688-A1 COMPOSITIONS AND METHODS FOR ENHANCED PROTEIN PRODUCTION HDT BIO CORP. 2024-08-01 US disclosed