SCHEMBL14090218

SCHEMBL14090218

O=C(c1ccc2nc(-c3cc(-c4cccc(Cl)c4)ccc3O)[nH]c2c1)N1CCN(CCO)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 2/20 0.48
▸ HDAC6 Q9UBN7 4/20 0.48
▸ CHEK2 O96017 2/20 0.45
▸ KLKB1 P03952 1/20 0.42
▸ F7 P08709 1/20 0.42
▸ SLC6A7 Q99884 2/20 0.42
▸ SLC6A3 Q01959 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ HDAC3 O15379 1/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC2 Q92769 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ BTK Q06187 1/20 0.41
▸ FGFR1 P11362 2/20 0.41
▸ KDR P35968 2/20 0.41
▸ PDGFRB P09619 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ FGFR2 P21802 1/20 0.40
▸ FGFR3 P22607 1/20 0.40
▸ ABL1 P00519 1/20 0.40

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
SCHEMBL14090244 0.91 MGLL (0.50) MGLLHDAC6CHEK2HDAC3HDAC1
SCHEMBL14090259 0.88 ACACB (0.46) MGLLHDAC6CHEK2F7LMNA
SCHEMBL14090211 0.87 PKN1 (0.44) MGLLHDAC6CHEK2HDAC3HDAC1
SCHEMBL14090262 0.87 ALDH1A1 (0.53) MGLLHDAC6CHEK2F7HDAC3
SCHEMBL14090220 0.86 HDAC6 (0.51) MGLLHDAC6CHEK2HDAC3HDAC1
SCHEMBL14090235 0.86 HDAC6 (0.42) MGLLHDAC6CHEK2HDAC3HDAC1
SCHEMBL14090202 0.85 SIRT2 (0.47) MGLLHDAC6CHEK2HDAC3HDAC1
SCHEMBL14090374 0.84 MGLL (0.41) MGLLHDAC6CHEK2HDAC3HDAC1
SCHEMBL14090345 0.81 AMY1A (0.49) MGLLHDAC6CHEK2F7HDAC3
SCHEMBL14090307 0.81 FGFR1 (0.46) MGLLHDAC6F7FGFR1KDR

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
US-8629147-B2 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2014-01-14 — — US disclosed
US-8629147-B2 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2014-01-14 — — US disclosed
US-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION 2008-08-28 — — US disclosed
US-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION 2008-08-28 — — 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-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders LCK, MALT1, MYD88 MGLL 3854/4885HDAC6 541/4885CHEK2 330/4885

“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.

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