SCHEMBL14009031

SCHEMBL14009031

COc1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(-n4cncn4)cc3)o2)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ S1PR4 O95977 2/20 0.51
▸ APOBEC3A P31941 1/20 0.46
▸ APOBEC3G Q9HC16 1/20 0.46
▸ MAPT P10636 6/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.44
▸ LMNA P02545 4/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ PKM P14618 2/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ TP53 P04637 2/20 0.43
▸ HPGD P15428 2/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ CA12 O43570 2/20 0.41
▸ CA1 P00915 2/20 0.41
▸ CA2 P00918 2/20 0.41
▸ CA9 Q16790 2/20 0.41
▸ MAPKAPK2 P49137 1/20 0.41

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
SCHEMBL14009028 0.89 MAPT (0.55) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL14009271 0.89 ALDH1A1 (0.46) S1PR4APOBEC3AAPOBEC3GMAPTMEN1
SCHEMBL14009015 0.86 MAPT (0.46) MAPTMEN1KMT2ALMNARAB9A
SCHEMBL14008940 0.86 APOBEC3A (0.49) S1PR4APOBEC3AAPOBEC3GMAPTMEN1
SCHEMBL14009303 0.85 MAPT (0.45) APOBEC3AAPOBEC3GMAPTMEN1KMT2A
SCHEMBL14008995 0.84 KDM4E (0.53) S1PR4APOBEC3AAPOBEC3GMAPTMEN1
SCHEMBL14009250 0.80 MAPT (0.53) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL14009058 0.78 ROCK1 (0.51) APOBEC3AAPOBEC3GMAPTMEN1KMT2A
SCHEMBL14009076 0.78 HTT (0.53) APOBEC3AAPOBEC3GMAPTMEN1KMT2A
SCHEMBL14009096 0.76 F10 (0.49) MAPTLMNARAB9ASMN1; SMN2RXFP1

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 S1PR4 2719/4885APOBEC3A 3662/4885APOBEC3G 3689/4885

“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.

Send feedback