SCHEMBL26819540

SCHEMBL26819540

c1ccc(-c2nc(-c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)c3c(n2)sc2ccccc23)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ ATM Q13315 1/20 0.39
▸ HPGD P15428 4/20 0.38
▸ ADORA2A P29274 6/20 0.37
▸ ADORA1 P30542 5/20 0.37
▸ LIMK1 P53667 2/20 0.34
▸ PIK3CA P42336 1/20 0.34
▸ PI4KA P42356 1/20 0.34
▸ PI4KB Q9UBF8 1/20 0.34
▸ WHR1 P49842 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ CASP3 P42574 1/20 0.34
▸ NFKB2 Q00653 1/20 0.34

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
SCHEMBL19106395 1.00 MEN1 (0.39) MEN1KMT2AATMHPGDADORA2A
SCHEMBL19106436 0.95 ADORA2A (0.39) MEN1KMT2AATMHPGDADORA2A
SCHEMBL19106456 0.95 MEN1 (0.35) MEN1KMT2AATMHPGDADORA2A
SCHEMBL19106413 0.95 ADORA2A (0.36) MEN1KMT2AATMHPGDADORA2A
SCHEMBL16902260 0.95 MEN1 (0.38) MEN1KMT2AATMHPGDADORA2A
SCHEMBL18370708 0.95 ADORA2A (0.39) MEN1KMT2AATMHPGDADORA2A
SCHEMBL19106440 0.94 MEN1 (0.39) MEN1KMT2AATMHPGDADORA2A
SCHEMBL19106466 0.94 ADORA2A (0.35) MEN1KMT2AATMHPGDADORA2A
SCHEMBL18370710 0.94 ADORA2A (0.39) MEN1KMT2AATMHPGDADORA2A
SCHEMBL18370709 0.94 ADORA2A (0.39) MEN1KMT2AATMHPGDADORA2A

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
US-20230389344-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2023-11-30 — — US disclosed
US-20230389344-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2023-11-30 — — US disclosed
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