SCHEMBL1703897

SCHEMBL1703897

[CH2]NC(=O)CNCCCN(CC)CC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 1/20 0.51
KDM4E B2RXH2 7/20 0.48
ALDH1A1 P00352 4/20 0.48
KMT2A Q03164 1/20 0.48
GAA P10253 2/20 0.40
LMNA P02545 2/20 0.38
KDM5A P29375 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
ALOX15 P16050 1/20 0.34
ACKR3 P25106 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 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
SCHEMBL17817817 0.89 KDM4E (0.47) PAOXKDM4EALDH1A1KMT2ALMNA
SCHEMBL1703887 0.88 GAA (0.44) PAOXKDM4EALDH1A1KMT2AGAA
SCHEMBL1703898 0.84 PAOX (0.53) PAOXKDM4EALDH1A1KMT2AGAA
Bicarbonate SCHEMBL30077237 0.77 PAOX (0.67) PAOXKDM4EALDH1A1KMT2AGAA
SCHEMBL759902 0.73 PAOX (0.61) PAOXKDM4EALDH1A1KMT2AGAA
SCHEMBL1703889 0.71 GAA (0.45) PAOXKDM4EALDH1A1KMT2AGAA
SCHEMBL9006871 0.71 KMT2A (0.44) PAOXKDM4EALDH1A1KMT2ALMNA
SCHEMBL9007157 0.70 HRH3 (0.44) PAOXKDM4EALDH1A1KMT2AGAA
SCHEMBL11465052 0.70 PAOX (0.58) PAOXKDM4EALDH1A1KMT2AGAA
SCHEMBL6033392 0.69 MEN1 (0.64) PAOXKDM4EALDH1A1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2954373-B1 CHEMICAL COATING FOR A LASER-MARKABLE MATERIAL FUJIFILM HUNT CHEMICALS US INC (US) 2019-04-24 EP disclosed
EP-2954373-A1 CHEMICAL COATING FOR A LASER-MARKABLE MATERIAL Fujifilm Hunt Chemicals US, Inc. (US) 2015-12-16 EP disclosed
WO-2014124052-A1 CHEMICAL COATING FOR A LASER-MARKABLE MATERIAL FUJIFILM HUNT CHEMICALS, INC. (US) 2014-08-14 WO disclosed
US-20130216947-A1 CHEMICAL COATING COMPOSITION FOR FORMING A LASER-MARKABLE MATERIAL AND A LASER-MARKABLE MATERIAL FUJIFILM HUNT CHEMICALS U.S.A., INC. 2013-08-22 US disclosed
EP-1892240-B1 Benzoisoindole derivative, pigment composition comprising the same and colored composition TOYO INK MFG CO (JP) 2012-04-18 EP disclosed
US-20080289541-A1 Benzoisoindole derivative, pigment composition comprising the same and colored composition TOYO INK MFG. CO., LTD. (JP) 2008-11-27 US disclosed
EP-1892240-A1 Benzoisoindole derivative, pigment composition comprising the same and colored composition TOYO INK MFG. CO., LTD. (JP) 2008-02-27 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-20080289541-A1 Benzoisoindole derivative, pigment composition comprising the same and colored composition TYR, BRI3BP, MITF PAOX 435/4885KDM4E 3437/4885ALDH1A1 747/4885

“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.