SCHEMBL31169441

SCHEMBL31169441

C=Cc1ccc2c(Nc3ccccc3)nc3nnc(CC)n3c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.37
▸ POLB P06746 1/20 0.36
▸ PDE8A O60658 1/20 0.36
▸ PDE4A P27815 1/20 0.36
▸ TP53 P04637 3/20 0.35
▸ HTR2C P28335 1/20 0.34
▸ SHMT2 P34897 1/20 0.34
▸ TUBB8B A6NNZ2 1/20 0.34
▸ EGFR P00533 1/20 0.34
▸ TUBB4A P04350 1/20 0.34
▸ TUBB P07437 1/20 0.34
▸ TUBA3C P0DPH7 1/20 0.34
▸ TUBA1B P68363 1/20 0.34
▸ TUBA4A P68366 1/20 0.34
▸ TUBB4B P68371 1/20 0.34
▸ TUBB3 Q13509 1/20 0.34
▸ TUBB2A Q13885 1/20 0.34
▸ TUBB8 Q3ZCM7 1/20 0.34
▸ TUBA3E Q6PEY2 1/20 0.34
▸ TUBA1A Q71U36 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
SCHEMBL30979104 0.86 TP53 (0.36) MAPTPOLBTP53EGFRRXFP1
SCHEMBL31169375 0.80 RXFP1 (0.42) MAPTPOLBPDE8APDE4ATP53
SCHEMBL30979033 0.80 MAPT (0.41) MAPTPOLBPDE8APDE4ATP53
SCHEMBL31169398 0.79 ABCG2 (0.47) EGFR
SCHEMBL31169427 0.77 TP53 (0.36) MAPTPOLBTP53EGFRRXFP1
SCHEMBL30979034 0.74 GAA (0.40) MAPTPOLBPDE4ATP53RXFP1
SCHEMBL30979068 0.73 TP53 (0.38) MAPTPOLBTP53EGFRNPY5R
SCHEMBL30978993 0.71 NPY5R (0.38) MAPTNPY5R
SCHEMBL30979107 0.71 GSK3B (0.39) MAPTPOLBNPY5R
SCHEMBL30978951 0.70 KDR (0.43) MAPTTP53EGFRRXFP1NPY5R

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
EP-4081305-B1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS CARNA BIOSCIENCES INC (JP) 2024-09-18 — — EP disclosed
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