SCHEMBL7056058

SCHEMBL7056058

CC(C)C[C@]1(COCc2ccccc2)CN(C(=O)OC(C)(C)C)CCN1Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.42
GPR119 Q8TDV5 1/20 0.42
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 1/20 0.40
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
MMP2 P08253 1/20 0.38
MMP13 P45452 1/20 0.38
ADAM17 P78536 1/20 0.38
ADAMTS5 Q9UNA0 1/20 0.38
STS P08842 1/20 0.38
ACHE P22303 1/20 0.38
GRM5 P41594 1/20 0.37
YAP1 P46937 2/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL5232600 0.79 OPRD1 (0.44) GPR119OPRD1OPRK1JAK2JAK1
SCHEMBL29247221 0.79 OPRD1 (0.43) TACR1GPR119OPRD1OPRK1JAK2
SCHEMBL5225612 0.77 OPRD1 (0.42) GPR119OPRD1OPRK1JAK2JAK1
SCHEMBL1049597 0.77 OPRD1 (0.49) TACR1GPR119OPRD1OPRK1JAK2
SCHEMBL19124768 0.76 OPRD1 (0.46) GPR119OPRD1OPRK1JAK2JAK1
SCHEMBL19124519 0.76 MEN1 (0.44) GPR119OPRD1OPRK1MEN1KMT2A
SCHEMBL17467896 0.75 OPRD1 (0.45) GPR119OPRD1OPRK1JAK2JAK1
SCHEMBL20722852 0.74 OPRD1 (0.45) GPR119OPRD1OPRK1JAK2JAK1
SCHEMBL28607334 0.73 OPRD1 (0.43) TACR1GPR119OPRD1OPRK1JAK2
SCHEMBL21731415 0.73 OPRD1 (0.44) GPR119OPRD1OPRK1JAK2JAK1

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-20030060473-A1 Piperazine compounds as inhibitors of MMP or TNF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-03-27 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-20030060473-A1 Piperazine compounds as inhibitors of MMP or TNF MMP2, MMP1, TNF TACR1 989/4885GPR119 2709/4885OPRD1 299/4885

“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.