SCHEMBL14009227

SCHEMBL14009227

COc1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(N4CCN(C)CC4)cc3)s2)c(C)c1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.60
▸ RAB9A P51151 6/20 0.60
▸ F10 P00742 11/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ POLB P06746 1/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ TP53 P04637 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ TSHR P16473 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ MEN1 O00255 1/20 0.49

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
SCHEMBL14009168 0.91 MAPT (0.57) NPC1RAB9AF10SMN1; SMN2KMT2A
SCHEMBL14009155 0.90 L3MBTL1 (0.60) NPC1RAB9AF10KMT2ATP53
SCHEMBL14009225 0.89 MAPKAPK2 (0.53) NPC1RAB9AF10SMN1; SMN2KMT2A
SCHEMBL14009158 0.80 NPC1 (0.54) NPC1RAB9AF10SMN1; SMN2KMT2A
SCHEMBL14009231 0.79 MAPT (0.52) NPC1RAB9AF10SMN1; SMN2KMT2A
SCHEMBL14009284 0.79 CA1 (0.50) NPC1RAB9AF10SMN1; SMN2KMT2A
SCHEMBL14009015 0.78 MAPT (0.46) NPC1RAB9AF10SMN1; SMN2KMT2A
SCHEMBL14009187 0.78 MEN1 (0.48) F10SMN1; SMN2KMT2AMAPTMEN1
SCHEMBL14009026 0.78 RAB9A (0.46) NPC1RAB9AF10SMN1; SMN2
SCHEMBL14009222 0.78 RXFP1 (0.51) NPC1RAB9AF10SMN1; SMN2POLB

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 NPC1 4547/4885RAB9A 3846/4885F10 3951/4885

“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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