SCHEMBL5886874

SCHEMBL5886874

COc1ccccc1CCNc1nc(C)c2ccc(=O)n(-c3ccc(C(=O)NCCC[N+](C)(C)[O-])cc3)c2n1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
POLB P06746 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
NAMPT P43490 1/20 0.38
P2RY12 Q9H244 1/20 0.38
LMNA P02545 2/20 0.37
RAB9A P51151 1/20 0.37
CASR P41180 1/20 0.36
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
ROCK2 O75116 1/20 0.36
ROCK1 Q13464 1/20 0.36
HPGD P15428 1/20 0.35
MAPK8 P45983 1/20 0.35
MAPK9 P45984 1/20 0.35
MAPK10 P53779 1/20 0.35
TGM2 P21980 1/20 0.35

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
SCHEMBL5887210 0.89 MAPT (0.42) MAPTMEN1KMT2APOLBTDP1
Dimethylamine SCHEMBL5887677 0.89 MAPT (0.42) MAPTMEN1KMT2APOLBTDP1
SCHEMBL5886877 0.88 MAPT (0.41) MAPTMEN1KMT2APOLBTDP1
SCHEMBL5886958 0.87 MAPT (0.46) MAPTMEN1KMT2APOLBTDP1
SCHEMBL5886801 0.87 MAPK8 (0.38) MAPTMEN1KMT2APOLBRAB9A
SCHEMBL5886913 0.86 P2RY12 (0.43) MAPTMEN1KMT2APOLBP2RY12
SCHEMBL5886738 0.86 RAB9A (0.42) MAPTMEN1KMT2APOLBTDP1
SCHEMBL5886991 0.85 MAPK8 (0.38) MAPTPOLBLMNAMAPK8MAPK9
SCHEMBL5886880 0.85 MAPT (0.34) MAPTMEN1KMT2ALMNARAB9A
SCHEMBL5886778 0.84 MAPT (0.44) MAPTMEN1KMT2ARAB9AMAPK8

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 MAPT 1614/4885MEN1 2183/4885KMT2A 1530/4885

“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.