SCHEMBL5209904

SCHEMBL5209904

Cc1cc(C)n(-c2nc(-c3ccc(Cl)cc3)c(CCC(=O)N3CCS(=O)(=O)CC3)o2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
GABRA5 P31644 1/20 0.37
MAPT P10636 3/20 0.36
RXFP1 Q9HBX9 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
USP2 O75604 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
PDE4B Q07343 2/20 0.35
PDE4D Q08499 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
ALOX5 P09917 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
HTT P42858 1/20 0.34
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
TACR1 P25103 1/20 0.33

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
SCHEMBL5208350 0.88 MAPT (0.40) POLBMAPTRXFP1SMN1; SMN2USP2
SCHEMBL5207937 0.84 TACR1 (0.46) POLBMAPTRXFP1SMN1; SMN2USP2
SCHEMBL5209029 0.83 POLB (0.47) POLBGABRA5MAPTRXFP1SMN1; SMN2
SCHEMBL5211551 0.83 RXRA (0.48) MAPTPDE4BPDE4DNPC1RAB9A
SCHEMBL5209589 0.83 POLB (0.50) POLBGABRA5MAPTRXFP1SMN1; SMN2
Trifluoroacetic Acid SCHEMBL5213276 0.80 TACR1 (0.42) POLBMAPTRXFP1SMN1; SMN2ALOX5
SCHEMBL5211815 0.79 POLB (0.47) POLBGABRA5MAPTSMN1; SMN2NPC1
SCHEMBL5210785 0.77 POLB (0.39) POLBGABRA5MAPTSMN1; SMN2NPC1
SCHEMBL5211741 0.77 POLB (0.38) POLBGABRA5MAPTSMN1; SMN2NPC1
SCHEMBL5210117 0.76 POLB (0.38) POLBGABRA5MAPTSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7183276-B2 Azole compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-27 US disclosed
US-20050090534-A1 Azole compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-04-28 US disclosed
EP-1486490-A1 AZOLE COMPOUNDS Takeda Chemical Industries, Ltd. (JP) 2004-12-15 EP 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-20050090534-A1 Azole compounds AHR, NR0B2, NR2C2 POLB 3507/4885GABRA5 1852/4885MAPT 3958/4885

“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.