SCHEMBL1676306

SCHEMBL1676306

CC(C)S(=O)(=O)Nc1cc(-c2ccc(C=Cc3nc(-c4ccc(Cl)cc4Cl)cn3Cc3ccc(C(=O)O)cc3)cc2)ccc1F

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NPC1 O15118 1/20 0.38
CRHBP P24387 1/20 0.38
RAB9A P51151 1/20 0.38
CRHR2 Q13324 1/20 0.38
ENPP2 Q13822 1/20 0.37
ACLY P53396 12/20 0.36
KCNA3 P22001 1/20 0.34
SRD5A2 P31213 1/20 0.33
CNR1 P21554 1/20 0.32
DRD2 P14416 1/20 0.32
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
PPARG P37231 1/20 0.32
KMT2A Q03164 1/20 0.32
NCOA2 Q15596 1/20 0.32
NCOA1 Q15788 1/20 0.32
NCOA3 Q9Y6Q9 1/20 0.32

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
SCHEMBL1676302 1.00 KDM4E (0.38) KDM4ESMN1; SMN2NPC1CRHBPRAB9A
SCHEMBL1676017 0.89 KDM4E (0.38) KDM4ESMN1; SMN2NPC1CRHBPRAB9A
SCHEMBL1676015 0.89 KDM4E (0.38) KDM4ESMN1; SMN2NPC1CRHBPRAB9A
SCHEMBL1676383 0.86 KDM4E (0.45) KDM4ESMN1; SMN2NPC1CRHBPRAB9A
SCHEMBL1676385 0.86 KDM4E (0.45) KDM4ESMN1; SMN2NPC1CRHBPRAB9A
SCHEMBL1483163 0.84 KDM4E (0.42) KDM4ESMN1; SMN2NPC1CRHBPRAB9A
SCHEMBL1483160 0.84 KDM4E (0.42) KDM4ESMN1; SMN2NPC1CRHBPRAB9A
SCHEMBL1676407 0.84 ACLY (0.41) KDM4ESMN1; SMN2NPC1CRHBPRAB9A
SCHEMBL1676404 0.84 ACLY (0.41) KDM4ESMN1; SMN2NPC1CRHBPRAB9A
SCHEMBL1481660 0.83 KDM4E (0.43) KDM4ESMN1; SMN2NPC1CRHBPRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110092553-A1 Substituted Azole Derivatives, Compositions, and Methods of Use TRANSTECH PHARMA, INC. (US) 2011-04-21 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-20110092553-A1 Substituted Azole Derivatives, Compositions, and Methods of Use PTPRO, PTPN5, PTPRE KDM4E 733/4885SMN1; SMN2 4417/4885NPC1 3228/4885

“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.