SCHEMBL5886808

SCHEMBL5886808

Cc1nc(N2CCN(c3ncccn3)CC2)nc2c1ccc(=O)n2-c1ccc(C(=O)NCCc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
HTT P42858 2/20 0.45
RAB9A P51151 7/20 0.43
MAPT P10636 5/20 0.43
NPC1 O15118 4/20 0.43
TP53 P04637 3/20 0.43
LMNA P02545 2/20 0.42
RXFP1 Q9HBX9 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
GAA P10253 1/20 0.41
ALDH1A1 P00352 2/20 0.41
TSHR P16473 1/20 0.41
SCD O00767 1/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ACHE P22303 1/20 0.40

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
SCHEMBL5886876 0.92 RAB9A (0.45) KDM4EHTTRAB9AMAPTNPC1
SCHEMBL5886707 0.92 ALDH1A1 (0.46) KDM4EHTTRAB9AMAPTTP53
SCHEMBL5886860 0.90 USP25 (0.46) RAB9AMAPTNPC1TP53LMNA
Dimethylamine SCHEMBL5887374 0.87 KDM4E (0.41) KDM4EHTTRAB9AMAPTNPC1
SCHEMBL5887435 0.87 L3MBTL1 (0.41) KDM4EHTTRAB9ANPC1TP53
SCHEMBL5887024 0.86 MAPT (0.44) KDM4EHTTRAB9AMAPTNPC1
SCHEMBL5887025 0.85 NPC1 (0.40) KDM4EHTTRAB9ANPC1ALDH1A1
SCHEMBL5887064 0.85 MEN1 (0.46) HTTMAPTLMNAGAAALDH1A1
SCHEMBL5887267 0.85 CTNNB1 (0.45) KDM4ERAB9AMAPTTP53LMNA
SCHEMBL5886865 0.85 KDM4E (0.39) KDM4EHTTRAB9ANPC1RXFP1

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 KDM4E 840/4885HTT 1319/4885RAB9A 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.