SCHEMBL3928173

SCHEMBL3928173

CS(=O)(=O)Nc1cc(C(=O)c2ccnc(Cl)c2)cc(-c2cccc3[nH]ccc23)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIP4K2A P48426 1/20 0.53
PIP4K2B P78356 1/20 0.53
PIP4K2C Q8TBX8 1/20 0.53
CHUK O15111 3/20 0.44
IKBKB O14920 1/20 0.44
HPGDS O60760 5/20 0.43
PIK3CD O00329 3/20 0.43
GSK3B P49841 3/20 0.43
PIM1 P11309 2/20 0.43
PIK3CB P42338 2/20 0.43
PIK3CA P42336 1/20 0.43
PIK3CG P48736 1/20 0.43
INSR P06213 2/20 0.42
MAPK8 P45983 2/20 0.42
CAMKK2 Q96RR4 2/20 0.42
FTO Q9C0B1 1/20 0.41
CDK2 P24941 1/20 0.39
CYP3A4 P08684 1/20 0.38
ROCK1 Q13464 1/20 0.38
PLCG1 P19174 1/20 0.38

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
SCHEMBL3931103 0.90 PIP4K2A (0.52) PIP4K2APIP4K2BPIP4K2CCHUKIKBKB
SCHEMBL3925497 0.88 PIP4K2A (0.60) PIP4K2APIP4K2BPIP4K2CCHUKIKBKB
SCHEMBL4794593 0.88 PIP4K2A (0.52) PIP4K2APIP4K2BPIP4K2CCHUKIKBKB
SCHEMBL3928756 0.87 HPGDS (0.46) PIP4K2APIP4K2BPIP4K2CHPGDSPIK3CD
SCHEMBL3933505 0.87 PIP4K2A (0.52) PIP4K2APIP4K2BPIP4K2CCHUKIKBKB
SCHEMBL4795668 0.86 HPGDS (0.46) PIP4K2APIP4K2BPIP4K2CHPGDSPIK3CD
SCHEMBL4793932 0.86 PIP4K2A (0.60) PIP4K2APIP4K2BPIP4K2CCHUKIKBKB
SCHEMBL3928580 0.83 PIP4K2A (0.59) PIP4K2APIP4K2BPIP4K2CCHUKIKBKB
SCHEMBL4795493 0.83 PIP4K2A (0.48) PIP4K2APIP4K2BPIP4K2CCHUKIKBKB
SCHEMBL3927726 0.82 HPGDS (0.44) HPGDSPIK3CDGSK3BPIM1PIK3CB

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090093479-A1 ANTI-CANCER AGENTS AND USES THEREOF LOCUS PHARMACEUTICALS, INC. (US) 2009-04-09 US claimed
US-7504401-B2 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. (US) 2009-03-17 US claimed
US-20080280891-A1 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. (US) 2008-11-13 US claimed
US-20060270686-A1 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. 2006-11-30 US claimed
US-20090093479-A1 ANTI-CANCER AGENTS AND USES THEREOF LOCUS PHARMACEUTICALS, INC. (US) 2009-04-09 US disclosed
US-7504401-B2 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. (US) 2009-03-17 US disclosed
US-20080280891-A1 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. (US) 2008-11-13 US disclosed
US-20060270686-A1 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. 2006-11-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090093479-A1 ANTI-CANCER AGENTS AND USES THEREOF H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, MCL1, CBR3 PIP4K2A 4139/4885PIP4K2B 4263/4885PIP4K2C 4366/4885
US-20060270686-A1 Anti-cancer agents and uses thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, MCL1, CBR3 PIP4K2A 4090/4885PIP4K2B 4221/4885PIP4K2C 4326/4885
US-20080280891-A1 Anti-cancer agents and uses thereof NR2E3, RB1, CBR3 PIP4K2A 4321/4885PIP4K2B 4353/4885PIP4K2C 4501/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.