SCHEMBL5447337

SCHEMBL5447337

Cc1c[c]c2nc(C(N)=O)ccc2c1C

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 9/20 0.35
PIM1 P11309 1/20 0.34
NNMT P40261 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
DGAT1 O75907 1/20 0.32
IKBKB O14920 2/20 0.31
LIMK1 P53667 1/20 0.31
SIRT3 Q9NTG7 1/20 0.30
MAP3K14 Q99558 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL5447285 0.85 GRM2 (0.33) GRM2PIM1NNMTTDP1KDM4E
SCHEMBL3050408 0.71 PIM1 (0.33) GRM2PIM1NNMTKDM4EIKBKB
SCHEMBL4484391 0.70 GRM2 (0.35) GRM2PIM1NNMTLMNA
SCHEMBL11973236 0.70 PIM1 (0.38) GRM2PIM1NNMTIKBKBLMNA
SCHEMBL4473023 0.70 NNMT (0.41) GRM2PIM1NNMTKDM4EIKBKB
SCHEMBL4473874 0.67 PIM1 (0.41) GRM2PIM1NNMTDGAT1IKBKB
SCHEMBL4482433 0.67 APP (0.43) GRM2PIM1NNMTKDM4E
SCHEMBL11973850 0.67 KMT2A (0.40) GRM2PIM1
SCHEMBL14955110 0.67 PIM1 (0.38) GRM2PIM1NNMTTDP1MAPT
SCHEMBL3341422 0.67 GRM2 (0.41) GRM2PIM1IKBKBLIMK1

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
US-20070254894-A1 Novel small molecules with selective cytotoxicity against human microvascular endothelial cell proliferation KANE JOHN L JR 2007-11-01 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 (1 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-20070254894-A1 Novel small molecules with selective cytotoxicity against human microvascular endothelial cell proliferation MKI67, VEGFA, KDR GRM2 4776/4885PIM1 971/4885NNMT 2050/4885

“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.