SCHEMBL5886986

SCHEMBL5886986

Cc1nc(Sc2nccn2C)nc2c1ccc(=O)n2-c1ccc(C(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.40
NR1H4 Q96RI1 1/20 0.40
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
RORC P51449 2/20 0.36
CCR1 P32246 1/20 0.36
NAMPT P43490 5/20 0.36
MAPK8 P45983 2/20 0.35
MAPT P10636 2/20 0.34
DRD2 P14416 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
RECQL P46063 1/20 0.34
BLM P54132 1/20 0.34
KMT2A Q03164 1/20 0.34
MCL1 Q07820 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HDAC1 Q13547 1/20 0.34
ELANE P08246 1/20 0.34

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
SCHEMBL5886724 0.90 MAPT (0.41) ALDH1A1LMNARORCMAPTPOLB
SCHEMBL5887016 0.89 SMN1; SMN2 (0.45) ALDH1A1LMNAMAPK8MAPTMEN1
SCHEMBL5886815 0.89 ALDH1A1 (0.40) EPHX2ALDH1A1LMNARORCNAMPT
SCHEMBL5887147 0.85 MAPT (0.44) ALDH1A1MAPTMEN1RECQLKMT2A
SCHEMBL5886833 0.84 CCR1 (0.43) EPHX2NR1H4ALDH1A1LMNARORC
SCHEMBL5886890 0.81 KLKB1 (0.38) NAMPTRECQLKMT2A
SCHEMBL5886792 0.81 MAPK8 (0.38) EPHX2NR1H4RORCMAPK8MAPT
SCHEMBL5886758 0.80 LMNA (0.39) EPHX2NR1H4ALDH1A1LMNARORC
SCHEMBL5886741 0.80 LMNA (0.42) ALDH1A1LMNAMAPTMEN1POLB
SCHEMBL5887027 0.78 KMT2A (0.45) EPHX2NR1H4ALDH1A1LMNARORC

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 EPHX2 2968/4885NR1H4 4783/4885ALDH1A1 1860/4885

“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.