SCHEMBL24767415

SCHEMBL24767415

CN(C(=O)Cc1ccc(-c2cc(F)ccc2F)cc1)c1nc(CO)cs1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 9/20 0.61
CA1 P00915 9/20 0.61
CA2 P00918 9/20 0.61
CA5A P35218 9/20 0.61
CA9 Q16790 9/20 0.61
CA5B Q9Y2D0 9/20 0.61
MAPT P10636 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
WNT3A P56704 1/20 0.39
LMNA P02545 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
EIF4E P06730 1/20 0.37
GRM1 Q13255 2/20 0.36

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
SCHEMBL20904178 0.88 CA12 (0.65) CA12CA1CA2CA5ACA9
SCHEMBL25893787 0.86 CA12 (0.59) CA12CA1CA2CA5ACA9
SCHEMBL25894205 0.84 CA12 (0.58) CA12CA1CA2CA5ACA9
SCHEMBL25892474 0.80 CA12 (0.55) CA12CA1CA2CA5ACA9
SCHEMBL25854821 0.80 CA12 (0.65) CA12CA1CA2CA5ACA9
SCHEMBL25854803 0.79 CA12 (0.63) CA12CA1CA2CA5ACA9
SCHEMBL25892626 0.78 CA12 (0.53) CA12CA1CA2CA5ACA9
SCHEMBL24767096 0.78 CA12 (0.74) CA12CA1CA2CA5ACA9
SCHEMBL24767087 0.78 CA12 (0.62) CA12CA1CA2CA5ACA9
SCHEMBL28424100 0.78 CA12 (0.59) CA12CA1CA2CA5ACA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4209491-A1 ENANTIOMERS OF SUBSTITUTED THIAZOLES AS ANTIVIRAL COMPOUNDS Innovative Molecules GmbH (DE) 2023-07-12 EP disclosed
EP-3692039-B1 ENANTIOMERS OF SUBSTITUTED THIAZOLES AS ANTIVIRAL COMPOUNDS INNOVATIVE MOLECULES GMBH (DE) 2022-12-14 EP disclosed
US-9611256-B2 Alkyne-, azide- and triazole-containing flavonoids as modulators for multidrug resistance in cancers THE HONG KONG POLYTECHNIC UNIVERSITY (HK) 2017-04-04 US disclosed