SCHEMBL161738

SCHEMBL161738

CCCNC(=O)c1cc(O)c2ccccc2c1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.56
ALDH1A1 P00352 3/20 0.56
L3MBTL1 Q9Y468 1/20 0.50
HDAC3 O15379 2/20 0.47
HDAC1 Q13547 2/20 0.47
HDAC2 Q92769 2/20 0.47
GAA P10253 2/20 0.47
HPGD P15428 1/20 0.47
EPHX1 P07099 1/20 0.47
POLB P06746 1/20 0.46
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
ERN1 O75460 1/20 0.45
NAAA Q02083 1/20 0.44
RIPK1 Q13546 1/20 0.43
MEN1 O00255 1/20 0.43

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
SCHEMBL162959 0.92 SMN1; SMN2 (0.57) KDM4EALDH1A1HDAC3HDAC1HDAC2
SCHEMBL10435868 0.89 NAAA (0.61) L3MBTL1HDAC3HDAC1HDAC2EPHX1
SCHEMBL162795 0.88 BRD4 (0.45) KDM4EALDH1A1HDAC3HDAC1HDAC2
SCHEMBL10695434 0.87 ALDH1A1 (0.57) KDM4EALDH1A1HDAC3HDAC1HDAC2
SCHEMBL161737 0.85 ALDH1A1 (0.56) KDM4EALDH1A1L3MBTL1HDAC3HDAC1
SCHEMBL160379 0.81 KMT2A (0.56) KDM4EALDH1A1GAAHPGDPOLB
SCHEMBL160412 0.80 PLK1 (0.50) KDM4EALDH1A1HPGD
SCHEMBL5668127 0.80 MAPT (0.56) KDM4EALDH1A1L3MBTL1GAAHPGD
SCHEMBL6360257 0.78 HDAC3 (0.72) KDM4EALDH1A1L3MBTL1HDAC3HDAC1
SCHEMBL28344151 0.78 HDAC6 (0.52) KDM4EHDAC3HDAC1HDAC2GAA

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-9856210-B2 Pharmaceutical composition for prevention and treatment of amyotrophic lateral sclerosis KYOTO UNIVERSITY (JP) 2018-01-02 US disclosed
EP-2611437-B1 PHARMACEUTICAL COMPOSITION FOR PREVENTION AND TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS UNIV KYOTO (JP) 2017-03-29 EP disclosed
US-20130225642-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION AND TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS KYOTO UNIVERSITY (JP) 2013-08-29 US disclosed
EP-2611437-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION AND TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS Kyoto University (JP) 2013-07-10 EP disclosed
WO-2012029994-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION AND TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS KYOTO UNIVERSITY (JP) 2012-03-08 WO disclosed
EP-0084890-B1 DIAZOTYPE HEAT DEVELOPMENT RECORDING MEDIUM Toppan Printing Co., Ltd. (JP) 1986-05-21 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-20130225642-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION AND TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS SMN1; SMN2, SOD1, SOD3 KDM4E 2214/4885ALDH1A1 1667/4885L3MBTL1 1654/4885

“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.