SCHEMBL5887463

SCHEMBL5887463

Cc1nc(N2CC3CC2CN3Cc2ccccc2)nc2c1ccc(=O)n2-c1ccc(C(=O)NC2CC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
OPRK1 P41145 3/20 0.42
MAPK8 P45983 1/20 0.42
HDAC1 Q13547 1/20 0.42
GAA P10253 2/20 0.41
KMT2A Q03164 2/20 0.41
TSHR P16473 1/20 0.41
CASP1 P29466 1/20 0.41
HTT P42858 1/20 0.39
TP53 P04637 3/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
KCNH2 Q12809 1/20 0.38
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.37

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
SCHEMBL5887234 0.90 HDAC1 (0.42) LMNASMN1; SMN2HDAC1GAAKMT2A
SCHEMBL5887531 0.88 HDAC1 (0.42) OPRK1HDAC1GAAJAK2JAK1
SCHEMBL5887131 0.87 HDAC1 (0.40) LMNASMN1; SMN2OPRK1HDAC1KMT2A
SCHEMBL5887537 0.85 ALDH1A1 (0.41) LMNASMN1; SMN2MAPK8HDAC1KMT2A
SCHEMBL5887359 0.85 MAOA (0.41) LMNASMN1; SMN2HDAC1
SCHEMBL5887403 0.84 PDE4B (0.39) OPRK1HDAC1KMT2AMEN1
SCHEMBL5887193 0.83 SMN1; SMN2 (0.43) LMNASMN1; SMN2TP53
SCHEMBL5887380 0.83 PPARG (0.41) LMNAMAPK8HDAC1KMT2ATP53
SCHEMBL5887437 0.83 LMNA (0.57) LMNASMN1; SMN2GAAKMT2ATSHR
SCHEMBL5887427 0.79 SMN1; SMN2 (0.46) LMNASMN1; SMN2MAPK8GAAKMT2A

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 LMNA 711/4885SMN1; SMN2 2219/4885OPRK1 4813/4885

“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.