SCHEMBL30979080

SCHEMBL30979080

c1ccc2c(c1)CCCN2c1nc2nncn2c2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.63
STAT3 P40763 1/20 0.63
ROCK1 Q13464 1/20 0.41
TUBB4A P04350 5/20 0.39
TUBB P07437 5/20 0.39
TUBA3C P0DPH7 5/20 0.39
TUBA1B P68363 5/20 0.39
TUBA4A P68366 5/20 0.39
TUBB4B P68371 5/20 0.39
TUBB3 Q13509 5/20 0.39
TUBB2A Q13885 5/20 0.39
TUBB8 Q3ZCM7 5/20 0.39
TUBA3E Q6PEY2 5/20 0.39
TUBA1A Q71U36 5/20 0.39
TUBA1C Q9BQE3 5/20 0.39
TUBB6 Q9BUF5 5/20 0.39
TUBB2B Q9BVA1 5/20 0.39
TUBB1 Q9H4B7 5/20 0.39
EGFR P00533 2/20 0.39
PDGFRB P09619 2/20 0.39

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
SCHEMBL23601720 1.00 KMT2A (0.63) KMT2ASTAT3ROCK1TUBB4ATUBB
SCHEMBL23578040 0.96 STAT3 (0.58) KMT2ASTAT3ROCK1TUBB4ATUBB
SCHEMBL29909558 0.96 STAT3 (0.58) KMT2ASTAT3ROCK1TUBB4ATUBB
SCHEMBL29909471 0.95 STAT3 (0.57) KMT2ASTAT3ROCK1TUBB4ATUBB
SCHEMBL23576798 0.95 STAT3 (0.57) KMT2ASTAT3ROCK1TUBB4ATUBB
SCHEMBL23576676 0.88 STAT3 (0.54) KMT2ASTAT3ROCK1TUBB4ATUBB
SCHEMBL29909921 0.88 STAT3 (0.54) KMT2ASTAT3ROCK1TUBB4ATUBB
SCHEMBL23601737 0.87 KMT2A (0.53) KMT2ASTAT3ROCK1TUBB4ATUBB
SCHEMBL29909671 0.87 KMT2A (0.53) KMT2ASTAT3ROCK1TUBB4ATUBB
SCHEMBL30013879 0.87 STAT3 (0.53) KMT2ASTAT3ROCK1TUBB4ATUBB

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
EP-4445902-A2 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2024-10-16 EP disclosed
CN-118324767-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-07-12 CN disclosed