SCHEMBL14009096

SCHEMBL14009096

COC(=O)c1cc(OC)ccc1NC(=O)c1ccc(C(=O)Nc2ccc(-n3cncn3)cc2)s1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 13/20 0.49
▸ MAPT P10636 1/20 0.44
▸ LMNA P02545 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ ICAM1 P05362 1/20 0.42
▸ SELE P16581 1/20 0.42
▸ VCAM1 P19320 1/20 0.42
▸ RAB9A P51151 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ F2 P00734 1/20 0.40
▸ F9 P00740 1/20 0.40
▸ PRSS1 P07477 1/20 0.40
▸ PRSS2 P07478 1/20 0.40
▸ F7 P08709 1/20 0.40
▸ PRSS3 P35030 1/20 0.40
▸ GRM7 Q14831 1/20 0.40
▸ SNCA P37840 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
SCHEMBL14009111 0.93 F10 (0.49) F10MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL14009015 0.89 MAPT (0.46) F10MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL14008925 0.87 SMN1; SMN2 (0.54) MAPTLMNAKDM4ESMN1; SMN2ICAM1
SCHEMBL14009219 0.84 KMT2A (0.53) MAPTLMNAKDM4ESMN1; SMN2RAB9A
SCHEMBL14009068 0.81 RAB9A (0.44) KDM4EICAM1SELEVCAM1RAB9A
SCHEMBL14008933 0.80 MAPT (0.45) F10MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL14009154 0.80 SMN1; SMN2 (0.54) MAPTKDM4ESMN1; SMN2RAB9A
SCHEMBL14009215 0.79 KMT2A (0.49) MAPTLMNAKDM4ESMN1; SMN2ICAM1
SCHEMBL14009071 0.79 MAPT (0.42) F10MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL14009080 0.79 MAPT (0.45) MAPTLMNAKDM4ESMN1; SMN2ICAM1

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-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

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 F10 3951/4885MAPT 2145/4885LMNA 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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