SCHEMBL28360967

SCHEMBL28360967

Fc1cc[c]c(-c2cc(F)c3nc[nH]c3c2)c1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 2/20 0.33
▸ MAPT P10636 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ PRNP P04156 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ PSMD11 O00231 1/20 0.31
▸ ALOX5AP P20292 1/20 0.31
▸ FEN1 P39748 1/20 0.31
▸ QPCTL Q9NXS2 1/20 0.31
▸ PIK3CA P42336 1/20 0.30
▸ MTOR P42345 1/20 0.30

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
SCHEMBL28357181 0.78 PSMD11 (0.48) QPCTMAPTALDH1A1HPGDSMN1; SMN2
SCHEMBL28357096 0.71 VRK1 (0.33) —
SCHEMBL616606 0.70 MAPT (0.41) QPCTMAPTMEN1ALDH1A1PRNP
SCHEMBL28360907 0.69 LMNA (0.37) ALDH1A1
SCHEMBL4453497 0.69 NOTUM (0.32) —
SCHEMBL9521923 0.68 NOTUM (0.35) —
SCHEMBL28360982 0.66 ADORA2A (0.38) —
SCHEMBL28360899 0.65 ADORA2A (0.38) HTTKMT2ASMN1; SMN2
SCHEMBL28357412 0.65 ADORA2A (0.32) MAPTMEN1KMT2A
SCHEMBL5797082 0.65 MAOB (0.35) MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110809577-A Modulators of adenosine A2A receptor 雷沃医疗有限公司 2020-02-18 — — CN claimed
CN-110809577-A Modulators of adenosine A2A receptor 雷沃医疗有限公司 2020-02-18 — — CN disclosed
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