SCHEMBL24558481

SCHEMBL24558481

O=C(O)CCCCC(=O)Nc1ccc(C(=O)Nc2cccc(Nc3cc(-c4c[nH]c5ccccc45)ncn3)c2)cc1

nearest known ligand 0.75

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIP4K2C Q8TBX8 14/20 0.75
PIP4K2A P48426 4/20 0.67
PIP4K2B P78356 4/20 0.67
PIKFYVE Q9Y2I7 1/20 0.67
EGFR P00533 2/20 0.49
ERBB3 P21860 1/20 0.49
CDK7 P50613 1/20 0.49
CCNH P51946 1/20 0.49

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
SCHEMBL24558484 0.86 PIP4K2C (0.82) PIP4K2CPIP4K2APIP4K2BPIKFYVECDK7
SCHEMBL24558504 0.86 PIP4K2C (0.67) PIP4K2CPIP4K2APIP4K2BPIKFYVECDK7
SCHEMBL24558485 0.84 PIP4K2C (0.80) PIP4K2CPIP4K2APIP4K2BPIKFYVECDK7
SCHEMBL18340770 0.80 PIP4K2A (0.84) PIP4K2CPIP4K2APIP4K2BPIKFYVECDK7
SCHEMBL30107628 0.80 PIP4K2A (1.00) PIP4K2CPIP4K2APIP4K2BPIKFYVECDK7
SCHEMBL20087925 0.80 PIP4K2A (1.00) PIP4K2CPIP4K2APIP4K2BPIKFYVECDK7
SCHEMBL24558610 0.79 PIP4K2C (0.58) PIP4K2CPIP4K2APIP4K2BPIKFYVE
SCHEMBL22143050 0.76 CDK7 (0.74) PIP4K2CPIP4K2APIP4K2BPIKFYVEEGFR
SCHEMBL24558505 0.76 PIP4K2C (1.00) PIP4K2C
SCHEMBL29736974 0.76 PIP4K2C (1.00) PIP4K2C

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
WO-2022140554-A1 SMALL MOLECULE DEGRADERS OF PHOSPHATIDYLINOSITOL-5-PHOSPHATE 4-KINASE TYPE 2 AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-06-30 WO disclosed