SCHEMBL23431252

SCHEMBL23431252

Cc1cccc(-n2cnc3c2C=CCC3)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ HPGD P15428 10/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ XDH P47989 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.37
▸ MGLL Q99685 1/20 0.37
▸ GRM1 Q13255 1/20 0.37
▸ FGFR1 P11362 1/20 0.36
▸ ADRB1 P08588 1/20 0.36
▸ TP53 P04637 1/20 0.35
▸ MAPT P10636 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
SCHEMBL5880449 0.69 ADRB1 (0.43) L3MBTL1HPGDALDH1A1XDHNPC1
SCHEMBL30269607 0.67 XDH (0.48) HPGDALDH1A1XDHNPC1GLA
SCHEMBL18381206 0.66 L3MBTL1 (0.40) L3MBTL1HPGDALDH1A1GLASMN1; SMN2
SCHEMBL8252602 0.66 DRD4 (0.33) —
SCHEMBL16147463 0.65 FGFR1 (0.68) HPGDALDH1A1FGFR1
SCHEMBL29829658 0.65 FGFR1 (0.68) HPGDALDH1A1FGFR1
SCHEMBL12786871 0.65 FGFR1 (0.59) HPGDALDH1A1NPC1GLARAB9A
SCHEMBL23016353 0.64 HPGD (0.59) HPGDALDH1A1NPC1GLARAB9A
SCHEMBL19039689 0.63 L3MBTL1 (0.38) L3MBTL1ALDH1A1HSP90AA1MGLLADRB1
SCHEMBL13211696 0.63 MAPK1 (0.42) ALDH1A1SMN1; SMN2

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-3828190-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE ORGANOMETALLIC COMPOUND AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE Samsung Electronics Co., Ltd. (KR) 2021-06-02 — — EP disclosed
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