SCHEMBL15810331

SCHEMBL15810331

CN(C)CCCNc1ccc2c3c(cccc13)C(=O)N(CCCCCC(=O)O)C2=O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.66
KDR P35968 2/20 0.66
PDGFRA P16234 1/20 0.66
HDAC1 Q13547 8/20 0.64
HDAC6 Q9UBN7 8/20 0.64
HDAC3 O15379 7/20 0.64
HDAC11 Q96DB2 7/20 0.64
HDAC8 Q9BY41 7/20 0.64
NCOR2 Q9Y618 6/20 0.64
HDAC7 Q8WUI4 3/20 0.64
HDAC2 Q92769 3/20 0.64
HDAC10 Q969S8 3/20 0.64
HDAC5 Q9UQL6 3/20 0.64
MEN1 O00255 4/20 0.61
POLB P06746 4/20 0.61
KMT2A Q03164 4/20 0.61
MAPT P10636 2/20 0.61
NPSR1 Q6W5P4 2/20 0.61
HTT P42858 2/20 0.61
RGS12 O14924 1/20 0.61

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
SCHEMBL17228671 0.88 FGFR1 (0.83) FGFR1KDRPDGFRAHDAC1HDAC6
SCHEMBL12463506 0.84 POLB (0.66) FGFR1KDRPDGFRAHDAC1HDAC6
SCHEMBL29165263 0.84 FGFR1 (0.80) FGFR1KDRPDGFRAHDAC1HDAC6
SCHEMBL21005693 0.83 FGFR1 (0.64) FGFR1KDRPDGFRAHDAC1HDAC6
SCHEMBL339370 0.83 POLB (0.64) FGFR1KDRPDGFRAHDAC1HDAC6
SCHEMBL16070381 0.82 MEN1 (0.61) FGFR1KDRPDGFRAHDAC1HDAC6
SCHEMBL16671948 0.81 HDAC1 (0.60) FGFR1KDRPDGFRAHDAC1HDAC6
SCHEMBL15797010 0.81 FGFR1 (0.53) FGFR1KDRPDGFRAHDAC1HDAC6
SCHEMBL1505144 0.81 MEN1 (0.70) FGFR1KDRPDGFRAHDAC1HDAC6
SCHEMBL1505234 0.81 MEN1 (0.70) FGFR1KDRPDGFRAHDAC1HDAC6

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
EP-2931714-B1 SUBSTITUTED QUINONES OR ANALOGUES AS COLOURING AGENTS MERCK PATENT GMBH (DE) 2016-12-21 EP disclosed
US-9458142-B2 Substituted quinones or analogues as colouring agents MERCK PATENT GMBH (DE) 2016-10-04 US disclosed
US-9458142-B2 Substituted quinones or analogues as colouring agents MERCK PATENT GMBH (DE) 2016-10-04 US disclosed
US-20150315177-A1 SUBSTITUTED QUINONES OR ANALOGUES AS COLOURING AGENTS MERCK PATENT GMBH (DE) 2015-11-05 US disclosed
US-20150315177-A1 SUBSTITUTED QUINONES OR ANALOGUES AS COLOURING AGENTS MERCK PATENT GMBH (DE) 2015-11-05 US disclosed
WO-2014090364-A1 SUBSTITUTED QUINONES OR ANALOGUES AS COLOURING AGENTS MERCK PATENT GMBH (DE) 2014-06-19 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-20150315177-A1 SUBSTITUTED QUINONES OR ANALOGUES AS COLOURING AGENTS KRT18, IK, SDHA FGFR1 2824/4885KDR 4509/4885PDGFRA 3590/4885

“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.