SCHEMBL2334848

SCHEMBL2334848

CCOC(=O)Cc1ccc(Cl)cc1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
TP53 P04637 2/20 0.46
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
HPGD P15428 2/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
MYC P01106 1/20 0.44
NR4A1 P22736 1/20 0.44
MAPT P10636 3/20 0.44
TSHR P16473 2/20 0.43
TDP1 Q9NUW8 2/20 0.42
KDM4E B2RXH2 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HSD17B10 Q99714 2/20 0.42
CASP1 P29466 1/20 0.42
LMNA P02545 1/20 0.42
ALOX15 P16050 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL3633768 0.89 MEN1 (0.47) ALDH1A1TP53MEN1KMT2AHPGD
SCHEMBL28942768 0.88 SMN1; SMN2 (0.46) ALDH1A1TP53MEN1KMT2AHPGD
SCHEMBL10514703 0.88 MAPK1 (0.48) ALDH1A1MEN1KMT2AHPGDCA1
SCHEMBL4608397 0.84 KDM4E (0.49) ALDH1A1TP53MEN1KMT2ACA1
SCHEMBL16731569 0.84 KMT2A (0.49) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL27792952 0.83 HRH3 (0.43) MYCTSHRKDM4ESMN1; SMN2LMNA
SCHEMBL31441299 0.83 KMT2A (0.57) ALDH1A1TP53MEN1KMT2AHPGD
SCHEMBL707398 0.83 KMT2A (0.57) ALDH1A1TP53MEN1KMT2AHPGD
SCHEMBL11867041 0.81 PPARG (0.55) MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL18641931 0.81 KMT2A (0.57) ALDH1A1MEN1KMT2AHPGDNR4A1

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
WO-2021126902-A1 AMIDO-SUBSTITUTED HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF HERPES VIRUSES MERCK SHARP & DOHME CORP. (US) 2021-06-24 WO disclosed
US-20110224208-A1 NOVEL INHIBITORS OF FLAVIVIRUS REPLICATION KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) 2011-09-15 US disclosed
US-20110224208-A1 NOVEL INHIBITORS OF FLAVIVIRUS REPLICATION KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) 2011-09-15 US disclosed
US-20110224208-A1 NOVEL INHIBITORS OF FLAVIVIRUS REPLICATION KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) 2011-09-15 US disclosed
EP-2358682-A2 ISOQUINOLONE DERIVATIVES AS INHIBITORS OF PLAVIVIRUS REPLICATION Katholieke Universiteit Leuven, K.U. Leuven R&D (BE) 2011-08-24 EP disclosed
WO-2010055164-A2 NOVEL INHIBITORS OF FLAVIVIRUS REPLICATION KATHOLIEKE UNIVERSITEIT LEUVEN, K.U.LEUVEN R&D (BE) 2010-05-20 WO 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-20110224208-A1 NOVEL INHIBITORS OF FLAVIVIRUS REPLICATION MAVS, IRF3, EIF2AK2 ALDH1A1 2613/4885TP53 3288/4885MEN1 4759/4885

“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.