SCHEMBL10322933

SCHEMBL10322933

Cc1ccc(C(=O)NCc2ccc(Cl)cc2)cc1C(N)=O

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
CYP2C19 P33261 2/20 0.56
NR1H4 Q96RI1 2/20 0.56
CYP1A2 P05177 1/20 0.56
RAB9A P51151 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
PPARG P37231 2/20 0.55
CYP2C9 P11712 1/20 0.51
HPGD P15428 2/20 0.50
POLB P06746 1/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPK14 Q16539 1/20 0.50
EPHX2 P34913 4/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49

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
SCHEMBL10321776 0.86 PPARG (0.67) HDAC8MEN1KMT2ACYP2C19CYP1A2
SCHEMBL10320558 0.86 ALDH1A1 (0.67) HDAC8NR1H4RAB9APPARGHPGD
SCHEMBL10318178 0.86 NPC1 (0.53) MEN1KMT2ASMN1; SMN2PPARGHPGD
SCHEMBL10322934 0.84 MEN1 (0.58) HDAC8MEN1KMT2ACYP2C19NR1H4
SCHEMBL11445833 0.80 NR1H4 (0.61) MEN1KMT2ACYP2C19NR1H4CYP1A2
SCHEMBL10321484 0.80 TP53 (0.59) HDAC8KMT2ASMN1; SMN2PPARGALDH1A1
SCHEMBL10321589 0.80 GRM5 (0.51) HDAC8KMT2ANR1H4RAB9ASMN1; SMN2
SCHEMBL14633899 0.80 FSHR (0.54) KMT2ASMN1; SMN2PPARG
SCHEMBL18917239 0.79 MEN1 (0.56) HDAC8MEN1KMT2ACYP2C19NR1H4
SCHEMBL8987867 0.78 MEN1 (0.78) HDAC8MEN1KMT2ACYP2C19CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012098066-A1 1,6- AND 1,8-NAPHTHYRIDINES USEFUL AS DYRK1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 WO claimed
US-20120184562-A1 1,6- AND 1,8-NAPHTHYRIDINES LUK KIN-CHUN (US) 2012-07-19 US claimed
WO-2012098066-A1 1,6- AND 1,8-NAPHTHYRIDINES USEFUL AS DYRK1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 WO disclosed
US-20120184562-A1 1,6- AND 1,8-NAPHTHYRIDINES LUK KIN-CHUN (US) 2012-07-19 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-20120184562-A1 1,6- AND 1,8-NAPHTHYRIDINES PSEN1, BRCA1, PSEN2 HDAC8 1024/4885MEN1 68/4885KMT2A 1774/4885

“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.