SCHEMBL31752889

SCHEMBL31752889

O=c1[nH][nH]c2c(Br)nc(C(F)(F)F)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ NT5E P21589 1/20 0.34
▸ KDM5B Q9UGL1 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ DAO P14920 2/20 0.33
▸ METAP2 P50579 1/20 0.33
▸ CHEK1 O14757 1/20 0.33
▸ AURKA O14965 1/20 0.33
▸ DAPK3 O43293 1/20 0.33
▸ JAK2 O60674 1/20 0.33
▸ PRKD3 O94806 1/20 0.33
▸ MAP4K4 O95819 1/20 0.33
▸ PAK4 O96013 1/20 0.33
▸ ABL1 P00519 1/20 0.33
▸ NTRK1 P04629 1/20 0.33
▸ CSF1R P07333 1/20 0.33
▸ RET P07949 1/20 0.33
▸ MET P08581 1/20 0.33
▸ PDGFRB P09619 1/20 0.33

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
SCHEMBL31753048 0.74 METAP2 (0.35) GAADAOMETAP2CHEK1AURKA
SCHEMBL31753788 0.69 ALDH1A1 (0.35) ALDH1A1GAAKDM5BMEN1KMT2A
SCHEMBL35210853 0.69 NT5E (0.33) NT5E
SCHEMBL35211775 0.66 METAP2 (0.39) NT5EMETAP2DYRK1AKDM4E
SCHEMBL855006 0.65 NT5E (0.47) ALDH1A1GAANT5EKDM5BHPGD
SCHEMBL24834865 0.63 ALDH1A1 (0.40) ALDH1A1GAAHPGDDAO
SCHEMBL30911391 0.63 NT5E (0.34) ALDH1A1NT5E
SCHEMBL30980088 0.61 CHEK1 (0.48) ALDH1A1GAADAOMETAP2CHEK1
SCHEMBL24665380 0.61 CHEK1 (0.48) ALDH1A1GAADAOMETAP2CHEK1
SCHEMBL23277298 0.60 ALDH1A1 (0.42) ALDH1A1NT5ECDK8MEN1KMT2A

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
WO-2025264818-A1 STAT6 MODULATORS AND METHODS OF USES THEREOF RAYTHERA, INC. (US) 2025-12-26 — — WO disclosed
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