SCHEMBL7620350

SCHEMBL7620350

O=C(Nc1nnc(C(F)(F)Cl)s1)c1c(O)c2cc(Br)ccc2oc1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 3/20 0.49
▸ CA9 Q16790 3/20 0.49
▸ KMT2A Q03164 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ NPC1 O15118 7/20 0.41
▸ RAB9A P51151 6/20 0.41
▸ HTT P42858 4/20 0.41
▸ SMN1; SMN2 Q16637 5/20 0.40
▸ LMNA P02545 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
▸ TAS1R3 Q7RTX0 1/20 0.37
▸ TAS1R1 Q7RTX1 1/20 0.37
▸ TAS1R2 Q8TE23 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ RXFP1 Q9HBX9 2/20 0.35
▸ PRNP P04156 1/20 0.35

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
SCHEMBL7613080 0.92 KMT2A (0.43) CA12CA9KMT2AMAPTMEN1
SCHEMBL7613159 0.83 MEN1 (0.43) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL7612240 0.83 KMT2A (0.46) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL7620367 0.83 KMT2A (0.45) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL7611892 0.82 MEN1 (0.52) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL7610344 0.81 MEN1 (0.56) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL7608718 0.78 MEN1 (0.57) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL9208153 0.78 NPC1 (0.64) CA12CA9KMT2AMAPTMEN1
SCHEMBL7618641 0.77 MEN1 (0.52) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL9207392 0.76 NPC1 (0.53) CA12CA9KMT2AMAPTMEN1

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-0869785-B1 4-HYDROXYCOUMARIN-3-CARBOXAMIDES FOR THE TREATMENT OF NON-INSULIN DEPENDENT DIABETES MELLITUS UPJOHN CO (US) 2002-08-28 — — EP claimed
Send feedback