SCHEMBL5206601

SCHEMBL5206601

O=C(CCc1oc(-c2ccc(Cl)c(Cl)c2)nc1-c1ccc(Cl)cc1)N1CCC(O)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
EIF4E P06730 1/20 0.39
MAPT P10636 2/20 0.39
TNKS O95271 2/20 0.38
PARP1 P09874 2/20 0.38
PARP2 Q9UGN5 2/20 0.38
CALCRL Q16602 1/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37
TACR1 P25103 2/20 0.37
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TP53 P04637 1/20 0.37
HTT P42858 1/20 0.37
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KMT2A Q03164 2/20 0.36

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
SCHEMBL5213743 0.84 TACR1 (0.49) POLBTACR1LMNASMN1; SMN2TP53
SCHEMBL5215135 0.83 POLB (0.44) POLBMAPTTNKSPARP1PARP2
SCHEMBL5212083 0.82 QPCT (0.44) POLBMAPTLMNASMN1; SMN2HTT
SCHEMBL5215239 0.81 HTR2C (0.44) POLBMAPTTNKSPARP1PARP2
SCHEMBL5211801 0.81 TACR1 (0.43) POLBMAPTTNKSPARP1PARP2
SCHEMBL5208646 0.80 POLB (0.45) POLBMAPTRXRARXRBRXRG
SCHEMBL5211972 0.79 TNKS (0.42) TNKSPARP1PARP2TACR1SMN1; SMN2
SCHEMBL5209815 0.78 TACR1 (0.41) POLBMAPTTNKSPARP1PARP2
SCHEMBL5213964 0.78 KMT2A (0.44) POLBMAPTTNKSPARP1PARP2
SCHEMBL5209112 0.77 POLB (0.40) POLBMAPTLMNASMN1; SMN2TP53

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 3507/4885EIF4E 3729/4885MAPT 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.