SCHEMBL5887084

SCHEMBL5887084

Cc1nc(N2CCN(c3ccccc3)CC2)nc2c1ccc(=O)n2-c1ccc(C(=O)Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.42
HPGD P15428 6/20 0.42
TSHR P16473 4/20 0.42
MAPT P10636 4/20 0.42
KMT2A Q03164 3/20 0.42
HTT P42858 2/20 0.42
HSD17B10 Q99714 7/20 0.41
CYP1A2 P05177 5/20 0.41
CASP1 P29466 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CASP7 P55210 3/20 0.41
CLK4 Q9HAZ1 1/20 0.41
CDK4 P11802 1/20 0.41
CCND1 P24385 1/20 0.41
CCND2 P30279 1/20 0.41
CCND3 P30281 1/20 0.41
RXRA P19793 1/20 0.39
USP2 O75604 3/20 0.39
CYP3A4 P08684 2/20 0.39
MGLL Q99685 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
SCHEMBL5886798 0.92 RXRA (0.47) ALDH1A1HPGDTSHRMAPTKMT2A
SCHEMBL5886834 0.91 MEN1 (0.44) ALDH1A1HPGDTSHRMAPTKMT2A
SCHEMBL5886830 0.90 ALDH1A1 (0.42) ALDH1A1HPGDTSHRMAPTKMT2A
SCHEMBL5886870 0.90 NPC1 (0.46) ALDH1A1TSHRMAPTKMT2AHTT
SCHEMBL5886843 0.88 KDM4E (0.43) ALDH1A1HPGDTSHRMAPTKMT2A
SCHEMBL5886809 0.85 ALDH1A1 (0.41) ALDH1A1HPGDTSHRMAPTKMT2A
SCHEMBL5887542 0.85 MAPK8 (0.45) ALDH1A1HPGDTSHRMAPTHTT
SCHEMBL5887072 0.84 ALDH1A1 (0.40) ALDH1A1MAPTRXRANPC1RAB9A
SCHEMBL5886891 0.84 TP53 (0.44) ALDH1A1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL5886930 0.84 MEN1 (0.44) ALDH1A1HPGDTSHRMAPTKMT2A

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 disclosed
US-20040009993-A1 Pyridopyrimidinones derivatives as telomerase inhibitors PHARMACIA ITALIA S.P.A. 2004-01-15 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 ALDH1A1 1860/4885HPGD 1371/4885TSHR 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.