SCHEMBL2862930

SCHEMBL2862930

CC(C)(C)OC(=O)N1CCN2C(=O)OC(c3ccccc3)(c3ccccc3)C2C1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.60
GPR119 Q8TDV5 2/20 0.55
ADRB2 P07550 1/20 0.55
APLNR P35414 1/20 0.55
GLP1R P43220 1/20 0.55
FFAR4 Q5NUL3 1/20 0.55
RORC P51449 6/20 0.43
USP30 Q70CQ3 3/20 0.41
HDAC6 Q9UBN7 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
ATM Q13315 1/20 0.40
SMARCA2 P51531 1/20 0.40
SMARCA4 P51532 1/20 0.40
PBRM1 Q86U86 1/20 0.40
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39

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
SCHEMBL2863389 0.94 NPSR1 (0.56) NPSR1GPR119ADRB2APLNRGLP1R
SCHEMBL2861921 0.94 NPSR1 (0.53) NPSR1GPR119ADRB2APLNRGLP1R
SCHEMBL2861988 0.90 NPSR1 (0.52) NPSR1GPR119ADRB2APLNRGLP1R
SCHEMBL2868953 0.88 NPSR1 (0.57) NPSR1GPR119ADRB2APLNRGLP1R
SCHEMBL2869200 0.88 NPSR1 (0.52) NPSR1GPR119ADRB2APLNRGLP1R
SCHEMBL2856780 0.85 NPSR1 (0.43) NPSR1GPR119ADRB2APLNRGLP1R
SCHEMBL2860641 0.84 NPSR1 (0.62) NPSR1GPR119ADRB2APLNRGLP1R
SCHEMBL2864501 0.82 NPSR1 (0.57) NPSR1GPR119ADRB2APLNRGLP1R
SCHEMBL2870570 0.82 NPSR1 (0.57) NPSR1GPR119ADRB2APLNRGLP1R
SCHEMBL2865918 0.82 NPSR1 (0.47) NPSR1GPR119ADRB2APLNRGLP1R

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-7795267-B2 Bicyclic piperazine compound having TGR23 antagonistic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-14 US disclosed
US-20070072865-A1 Bicyclic piperazine compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-29 US disclosed
EP-1661898-A1 BICYCLIC PIPERAZINE COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2006-05-31 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-20070072865-A1 Bicyclic piperazine compound and use thereof GPR3, FFAR3, LPAR3 NPSR1 211/4885GPR119 75/4885ADRB2 449/4885

“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.