SCHEMBL4098207

SCHEMBL4098207

Cc1c[nH]c(=O)n(Cc2ccccc2)c1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
HPGD P15428 6/20 0.51
ALDH1A1 P00352 5/20 0.51
KDM4E B2RXH2 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
BRD4 O60885 2/20 0.50
C5AR1 P21730 1/20 0.50
MAPK1 P28482 1/20 0.49
RGS12 O14924 1/20 0.48
USP2 O75604 1/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
TLR7 Q9NYK1 1/20 0.48
PSMD14 O00487 1/20 0.48
TSHR P16473 1/20 0.48
HTT P42858 1/20 0.48
CYP3A4 P08684 1/20 0.47
LMNA P02545 1/20 0.47
ATM Q13315 1/20 0.47

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
SCHEMBL4763627 0.84 MEN1 (0.44) MEN1KMT2AHPGDALDH1A1KDM4E
SCHEMBL2786159 0.80 ALDH1A1 (0.54) MEN1KMT2AHPGDALDH1A1BRD4
SCHEMBL4164688 0.80 ALDH1A1 (0.51) MEN1KMT2AHPGDALDH1A1KDM4E
SCHEMBL1584775 0.80 ALDH1A1 (0.51) MEN1KMT2AHPGDALDH1A1KDM4E
SCHEMBL7521745 0.80 ALDH1A1 (0.48) MEN1KMT2AHPGDALDH1A1KDM4E
SCHEMBL27422649 0.80 ALDH1A1 (0.49) KMT2AHPGDALDH1A1KDM4ESMN1; SMN2
SCHEMBL11315740 0.79 HPGD (0.50) MEN1KMT2AHPGDALDH1A1KDM4E
SCHEMBL15978138 0.79 FPR1 (0.51) MEN1KMT2AHPGDALDH1A1KDM4E
Hydrogen Sulfide SCHEMBL27583639 0.79 HPGD (0.50) MEN1KMT2AHPGDALDH1A1KDM4E
SCHEMBL3993882 0.76 KDM4E (0.48) HPGDALDH1A1KDM4ESMN1; SMN2HTT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090203910-A1 Deprotection of N-BOC compounds ROCH PALO ALTO LLC 2009-08-13 US disclosed
EP-2070899-A1 Deprotection of N-BOC compounds F. HOFFMANN-LA ROCHE AG (CH) 2009-06-17 EP disclosed
EP-0748800-B1 Pyrimidinedione, pyrimidinetrione, triazinedione derivatives as alpha-1-adrenergic receptor antagonists HOFFMANN LA ROCHE (CH) 2001-05-09 EP disclosed
US-5869666-A Conformationally locked nucleoside analogues THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1999-02-09 US disclosed
US-5859014-A USEFUL IN TREATMENT OF DISEASES INVOLVING DIRECTLY OR INDIRECTLY AN OBSTRUCTION OF THE LOWER URINARY TRACT, SUCH ASBENIGN PROSTATE HYPERPLASIA SYNTEX (U.S.A.) INC. (US) 1999-01-12 US disclosed
EP-0748800-A2 Pyrimidinedione, pyrimidinetrione, triazinedione, tetrahydroquinazolinedione derivatives as alpha-1-adrenergic receptor antagonists F. HOFFMANN-LA ROCHE AG (CH) 1996-12-18 EP 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-20090203910-A1 Deprotection of N-BOC compounds NUCB2, TERT, CEL MEN1 425/4885KMT2A 2901/4885HPGD 2976/4885

“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.