SCHEMBL3498121

SCHEMBL3498121

COc1cccc(COc2ccc(C[C@H](NC(=O)c3cn4ccc(-c5ccc(Cl)cc5)cc4n3)C(=O)O)cc2)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR34 Q9UPC5 6/20 0.52
GPR132 Q9UNW8 3/20 0.48
PTPN1 P18031 3/20 0.46
EGLN1 Q9GZT9 1/20 0.43
MME P08473 1/20 0.43
CDK2 P24941 1/20 0.42
ITGB1 P05556 3/20 0.41
ITGA4 P13612 3/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAOB P27338 1/20 0.41
ITGB7 P26010 1/20 0.41

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
SCHEMBL3498119 1.00 GPR34 (0.52) GPR34GPR132PTPN1EGLN1MME
SCHEMBL3500279 0.94 CDK2 (0.48) GPR34GPR132EGLN1MMECDK2
SCHEMBL3500276 0.94 CDK2 (0.48) GPR34GPR132EGLN1MMECDK2
SCHEMBL3500080 0.92 GPR34 (0.53) GPR34GPR132PTPN1CDK2ITGB1
SCHEMBL3500077 0.92 GPR34 (0.53) GPR34GPR132PTPN1CDK2ITGB1
SCHEMBL3498605 0.92 GPR34 (0.62) GPR34GPR132PTPN1
SCHEMBL3497834 0.92 GPR34 (0.62) GPR34GPR132PTPN1
SCHEMBL3498322 0.91 GPR34 (0.58) GPR34GPR132PTPN1CDK2
SCHEMBL3498320 0.91 GPR34 (0.58) GPR34GPR132PTPN1CDK2
SCHEMBL3499677 0.90 GPR34 (0.55) GPR34GPR132PTPN1ITGB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100130737-A1 Regulating Agent of GPR34 Receptor Function TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-27 US disclosed
EP-1849465-A1 AGENT FOR CONTROLLING FUNCTION OF GPR34 RECEPTOR Takeda Pharmaceutical Company Limited (JP) 2007-10-31 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-20100130737-A1 Regulating Agent of GPR34 Receptor Function GPR34, GPR4, GPR6 GPR34 1/4885GPR132 13/4885PTPN1 3494/4885

“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.