SCHEMBL19868331

SCHEMBL19868331

CCc1cccc(OCCN(C)C)c1C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 1/20 0.52
LMNA P02545 3/20 0.49
MAPT P10636 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 1/20 0.49
RXFP1 Q9HBX9 2/20 0.49
GAA P10253 2/20 0.48
RAB9A P51151 1/20 0.48
GRM4 Q14833 1/20 0.47
KDR P35968 4/20 0.47
KCNJ5 P48544 1/20 0.47
KCNJ3 P48549 1/20 0.47
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
TRPV1 Q8NER1 2/20 0.45
RAF1 P04049 1/20 0.45
HTT P42858 1/20 0.44

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
SCHEMBL29677914 0.91 RXFP1 (0.49) UTS2RLMNAMAPTMEN1KMT2A
SCHEMBL31376514 0.91 RXFP1 (0.49) UTS2RLMNAMAPTMEN1KMT2A
SCHEMBL22339734 0.91 RXFP1 (0.49) UTS2RLMNAMAPTMEN1KMT2A
SCHEMBL9951429 0.91 RXFP1 (0.49) UTS2RLMNAMAPTMEN1KMT2A
SCHEMBL22339325 0.90 RXFP1 (0.49) UTS2RLMNAMAPTMEN1KMT2A
SCHEMBL22339742 0.90 MAPT (0.55) UTS2RLMNAMAPTMEN1KMT2A
SCHEMBL22339748 0.90 KDR (0.50) UTS2RLMNAMAPTMEN1KMT2A
SCHEMBL18804926 0.90 RXFP1 (0.49) UTS2RLMNAMAPTMEN1KMT2A
SCHEMBL22339751 0.88 RXFP1 (0.48) UTS2RLMNAMAPTMEN1KMT2A
SCHEMBL9952083 0.87 RXFP1 (0.50) UTS2RLMNAMAPTMEN1KMT2A

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-2654428-B1 HISTONE ACETYLTRANSFERASE MODULATORS AND USESE THEREOF UNIV COLUMBIA (US) 2018-02-14 EP disclosed