SCHEMBL5887401

SCHEMBL5887401

Cc1nc(N2CCC(Cc3ccccc3)CC2)nc2c1ccc(=O)n2-c1ccc(C(N)=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
MGLL Q99685 1/20 0.43
TSHR P16473 2/20 0.42
KDM1A O60341 1/20 0.41
SCN9A Q15858 1/20 0.40
HDAC6 Q9UBN7 2/20 0.40
MAPT P10636 3/20 0.38
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
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
SCHEMBL5887427 0.88 SMN1; SMN2 (0.46) GAAMGLLTSHRSCN9AHDAC6
SCHEMBL5887179 0.88 MEN1 (0.50) MGLLSCN9AHDAC6MAPTSMN1; SMN2
SCHEMBL5886852 0.86 LMNA (0.46) GAATSHRHDAC6MAPTLMNA
SCHEMBL5886830 0.85 ALDH1A1 (0.42) TSHRMAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL5886902 0.84 GBA1 (0.46) GAATSHRMAPTSMN1; SMN2ALDH1A1
SCHEMBL5887038 0.83 MEN1 (0.47) LMNASMN1; SMN2ALDH1A1
SCHEMBL5886837 0.83 KMT2A (0.47) TSHRLMNASMN1; SMN2
SCHEMBL5886866 0.83 SMN1; SMN2 (0.50) MAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL5886996 0.82 MEN1 (0.46) GAATSHRLMNASMN1; SMN2ALDH1A1
SCHEMBL5887743 0.82 HDAC1 (0.41) TSHRSMN1; SMN2KDM4E

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 3 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
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 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-20040009993-A1 Pyridopyrimidinones derivatives as telomerase inhibitors TERT, TERF2, TERF2IP GAA 2823/4885MGLL 4759/4885TSHR 3292/4885

“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.