SCHEMBL20565746

SCHEMBL20565746

Cc1cc(OC(F)(F)F)ccc1NC(=O)Oc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
DHODH Q02127 1/20 0.50
ALDH1A1 P00352 7/20 0.48
GAA P10253 4/20 0.48
KDM4E B2RXH2 2/20 0.48
HPGD P15428 2/20 0.48
GLA P06280 1/20 0.48
ATM Q13315 1/20 0.48
IGF2BP2 Q9Y6M1 1/20 0.46
CYP1A2 P05177 2/20 0.46
RAB9A P51151 3/20 0.45
KDR P35968 2/20 0.45
BRAF P15056 1/20 0.45
NPC1 O15118 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
POLB P06746 1/20 0.43
THRB P10828 1/20 0.43

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
SCHEMBL29739710 0.90 KMT2A (0.53) KMT2ADHODHALDH1A1GAAKDM4E
SCHEMBL29739233 0.85 RAB9A (0.56) KMT2ADHODHALDH1A1GAAKDM4E
SCHEMBL20565563 0.85 ALDH1A1 (0.52) KMT2AALDH1A1GAAKDM4EHPGD
SCHEMBL7383350 0.84 DHODH (0.51) KMT2ADHODHALDH1A1GAAKDM4E
SCHEMBL17372913 0.84 MEN1 (0.56) KMT2ADHODHALDH1A1GAAKDM4E
SCHEMBL17372922 0.84 HTT (0.56) KMT2AALDH1A1GAAATMRAB9A
SCHEMBL21305450 0.83 KMT2A (0.54) KMT2ADHODHALDH1A1GAAKDM4E
SCHEMBL15821915 0.83 RAB9A (0.59) KMT2AALDH1A1GAAKDM4EHPGD
SCHEMBL6676510 0.83 IGF2BP2 (0.62) DHODHGAAHPGDIGF2BP2CYP1A2
SCHEMBL16907381 0.83 RAB9A (0.56) KMT2ADHODHALDH1A1GAAKDM4E

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-3157922-B1 PYRAZOLO-PYRIDINE DERIVATIVES AS KINASE INHIBITORS UCB BIOPHARMA SPRL (BE) 2018-11-28 EP disclosed