SCHEMBL5887294

SCHEMBL5887294

Cc1nc(N2CCC[C@H]2C(=O)O)nc2c1ccc(=O)n2-c1ccc(C(=O)NC2CC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 1/20 0.39
SMYD3 Q9H7B4 2/20 0.38
HRH3 Q9Y5N1 1/20 0.37
TP53 P04637 2/20 0.37
HPGD P15428 2/20 0.37
MAPK1 P28482 1/20 0.37
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
HSD11B1 P28845 1/20 0.36
THRB P10828 1/20 0.36
MAPK14 Q16539 1/20 0.36

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
SCHEMBL5886972 0.86 MEN1 (0.37) RAB9ATSHRSMN1; SMN2LMNAHPGD
SCHEMBL5886823 0.86 SMYD3 (0.48) MAPK8NPC1RAB9ATSHRSMN1; SMN2
SCHEMBL5886844 0.86 MAPT (0.44) NPC1RAB9ATSHRSMN1; SMN2LMNA
SCHEMBL5887335 0.86 L3MBTL1 (0.39) SMN1; SMN2LMNATP53HPGDKMT2A
SCHEMBL5886906 0.85 MMP13 (0.40) RAB9ATSHRSMN1; SMN2LMNAHPGD
SCHEMBL5886746 0.85 ALDH1A1 (0.44) RAB9ASMN1; SMN2LMNATP53MAPK1
SCHEMBL5887542 0.83 MAPK8 (0.45) MAPK8RAB9ATSHRSMN1; SMN2LMNA
SCHEMBL5887033 0.83 MAPK8 (0.40) MAPK8NPC1RAB9ATSHRSMN1; SMN2
SCHEMBL5887620 0.83 HPGD (0.54) NPC1RAB9ASMN1; SMN2LMNAHPGD
SCHEMBL5887242 0.83 BRD4 (0.47) SMYD3MAPK14

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
US-7019002-B2 Substituted on 8th position with benzoic acid, ester or amide groups; anticancer agents PHARMACIA & UPJOHN, S.P.A. (IT) 2006-03-28 US claimed
US-20040009993-A1 Pyridopyrimidinones derivatives as telomerase inhibitors PHARMACIA ITALIA S.P.A. 2004-01-15 US claimed

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-20040009993-A1 Pyridopyrimidinones derivatives as telomerase inhibitors TERT, TERF2, TERF2IP MAPK8 770/4885NPC1 4067/4885RAB9A 3217/4885

“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.