SCHEMBL14009028

SCHEMBL14009028

COc1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(-n4cncn4)cc3)o2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.55
▸ ALDH1A1 P00352 7/20 0.55
▸ LMNA P02545 6/20 0.55
▸ RAB9A P51151 6/20 0.55
▸ NPC1 O15118 4/20 0.55
▸ SMN1; SMN2 Q16637 4/20 0.55
▸ PKM P14618 1/20 0.55
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ MAPKAPK2 P49137 1/20 0.50
▸ TP53 P04637 3/20 0.49
▸ HPGD P15428 2/20 0.49
▸ CYP1A2 P05177 2/20 0.48
▸ CYP2C9 P11712 2/20 0.48
▸ CYP2C19 P33261 2/20 0.48
▸ CASP3 P42574 1/20 0.48
▸ SENP7 Q9BQF6 1/20 0.48
▸ SENP6 Q9GZR1 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ MAPK8 P45983 1/20 0.47

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
SCHEMBL14009250 0.90 MAPT (0.53) MAPTALDH1A1LMNARAB9ANPC1
SCHEMBL14009031 0.89 S1PR4 (0.51) MAPTALDH1A1LMNARAB9ANPC1
SCHEMBL14009058 0.85 ROCK1 (0.51) MAPTALDH1A1LMNARAB9ANPC1
SCHEMBL14009076 0.85 HTT (0.53) MAPTALDH1A1LMNARAB9ANPC1
SCHEMBL14008925 0.84 SMN1; SMN2 (0.54) MAPTALDH1A1LMNARAB9ANPC1
SCHEMBL14009303 0.84 MAPT (0.45) MAPTALDH1A1LMNARAB9ANPC1
SCHEMBL14009271 0.81 ALDH1A1 (0.46) MAPTALDH1A1LMNARAB9ANPC1
SCHEMBL14008995 0.81 KDM4E (0.53) MAPTALDH1A1LMNARAB9ANPC1
SCHEMBL14008956 0.78 SMYD3 (0.48) MAPTALDH1A1LMNARAB9ANPC1
SCHEMBL2095209 0.78 CYP1A2 (0.63) MAPTALDH1A1SMN1; SMN2HPGDCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7446195-B2 High affinity thiophene-based and furan-based kinase ligands SCHERING CORPORATION (US) 2008-11-04 — — US disclosed
US-7446195-B2 High affinity thiophene-based and furan-based kinase ligands SCHERING CORPORATION (US) 2008-11-04 — — US disclosed
US-20070043045-A1 Novel high affinity thiophene-based and furan-based kinase ligands SCHERING CORPORATION 2007-02-22 — — US disclosed
US-20070043045-A1 Novel high affinity thiophene-based and furan-based kinase ligands SCHERING CORPORATION 2007-02-22 — — US disclosed
WO-2007022258-A1 NOVEL HIGH AFFINITY THIOPHENE-BASED AND FURAN-BASED KINASE LIGANDS SCHERING CORPORATION (US) 2007-02-22 — — 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-20070043045-A1 Novel high affinity thiophene-based and furan-based kinase ligands CDKL2, CDK2, CDKL1 MAPT 2145/4885ALDH1A1 4225/4885LMNA 3745/4885

“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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