SCHEMBL14090259

SCHEMBL14090259

O=C(c1ccc2nc(-c3cc(-c4cccnc4)ccc3O)[nH]c2c1)N1CCN(CCO)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 1/20 0.46
▸ HTR2B P41595 1/20 0.45
▸ ABL1 P00519 3/20 0.44
▸ BCR P11274 3/20 0.44
▸ FHIT P49789 1/20 0.44
▸ MGLL Q99685 2/20 0.44
▸ MKNK1 Q9BUB5 1/20 0.43
▸ MKNK2 Q9HBH9 1/20 0.43
▸ F7 P08709 1/20 0.43
▸ HPGD P15428 2/20 0.42
▸ GHSR Q92847 1/20 0.42
▸ CHEK2 O96017 1/20 0.41
▸ FGFR1 P11362 2/20 0.41
▸ KDR P35968 2/20 0.41
▸ PDGFRB P09619 1/20 0.41
▸ DRD2 P14416 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ LMNA P02545 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ MAPT P10636 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) ACACBHTR2BMGLLGHSRCHEK2
SCHEMBL14090211 0.91 PKN1 (0.44) ACACBMGLLCHEK2FGFR1KDR
SCHEMBL14090218 0.88 MGLL (0.48) ABL1BCRMGLLF7CHEK2
SCHEMBL14090374 0.88 MGLL (0.41) MGLLCHEK2FGFR1KDRPDGFRB
SCHEMBL14090252 0.86 ACACB (0.49) ACACBHTR2BABL1BCRFHIT
SCHEMBL14090235 0.86 HDAC6 (0.42) MGLLCHEK2FGFR1KDRPDGFRB
SCHEMBL14090262 0.85 ALDH1A1 (0.53) ACACBMGLLF7CHEK2FGFR1
SCHEMBL14090202 0.85 SIRT2 (0.47) ABL1BCRMGLLCHEK2FGFR1
SCHEMBL14090226 0.84 CARM1 (0.46) ACACBABL1BCRMGLLCHEK2
SCHEMBL14090345 0.81 AMY1A (0.49) MGLLF7CHEK2FGFR1KDR

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 ACACB 1636/4885HTR2B 3676/4885ABL1 37/4885

“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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