SCHEMBL30600015

SCHEMBL30600015

OB(O)c1ncnc(-c2ccccc2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ MGLL Q99685 2/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ NFKB2 Q00653 1/20 0.38
▸ RELA Q04206 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ KMO O15229 1/20 0.37
▸ CSF1R P07333 1/20 0.37
▸ PDGFRB P09619 1/20 0.37
▸ GSK3A P49840 1/20 0.37
▸ CDK9 P50750 1/20 0.37
▸ CDK5 Q00535 1/20 0.37
▸ ACVR1 Q04771 1/20 0.37
▸ CDK5R1 Q15078 1/20 0.37
▸ TAOK1 Q7L7X3 1/20 0.37
▸ DYRK1B Q9Y463 1/20 0.37

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
SCHEMBL29072353 0.82 ESR1 (0.46) SMN1; SMN2CA1CA2L3MBTL1LMNA
SCHEMBL14603340 0.79 L3MBTL1 (0.52) NPC1RAB9AMAPK1SMN1; SMN2MGLL
SCHEMBL28917347 0.79 CA1 (0.61) NPC1RAB9AMAPK1SMN1; SMN2MGLL
SCHEMBL56387 0.79 L3MBTL1 (0.54) NPC1RAB9AMAPK1SMN1; SMN2NFKB1
Ammonia Solution, Strong SCHEMBL28360184 0.77 L3MBTL1 (0.52) NPC1RAB9AMAPK1SMN1; SMN2NFKB1
SCHEMBL28655787 0.76 MGLL (0.50) NPC1RAB9AMAPK1SMN1; SMN2MGLL
SCHEMBL19057481 0.76 MGLL (0.50) NPC1RAB9AMAPK1SMN1; SMN2MGLL
SCHEMBL28491899 0.75 L3MBTL1 (0.46) NPC1RAB9AMAPK1SMN1; SMN2NFKB1
SCHEMBL23008430 0.74 NPC1 (0.52) NPC1RAB9AMAPK1SMN1; SMN2NFKB1
SCHEMBL16922581 0.74 NPC1 (0.52) NPC1RAB9AMAPK1SMN1; SMN2NFKB1

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
CN-116751229-A OLED luminescent organic material and OLED luminescent device thereof 上海钥熠电子科技有限公司 2023-09-15 — — CN disclosed
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