SCHEMBL3498404

SCHEMBL3498404

CSCCC(NC(=O)c1oc2cc(-c3ccc(Cl)cc3)ccc2c1C)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
USP2 O75604 1/20 0.45
TSHR P16473 1/20 0.45
FNTA P49354 4/20 0.45
FNTB P49356 4/20 0.45
MCL1 Q07820 1/20 0.45
GAA P10253 1/20 0.45
FPR1 P21462 1/20 0.44
CA2 P00918 3/20 0.43
CA1 P00915 2/20 0.43
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
MEN1 O00255 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
SCHEMBL3498408 1.00 ALDH1A1 (0.49) ALDH1A1NPSR1USP2TSHRFNTA
SCHEMBL3499404 0.90 PPID (0.41) ALDH1A1NPSR1TSHRFNTAFNTB
SCHEMBL3499402 0.90 PPID (0.41) ALDH1A1NPSR1TSHRFNTAFNTB
SCHEMBL3501304 0.87 ALDH1A1 (0.44) ALDH1A1NPSR1USP2TSHRFNTA
SCHEMBL3501302 0.87 ALDH1A1 (0.44) ALDH1A1NPSR1USP2TSHRFNTA
SCHEMBL3498868 0.83 KMT2A (0.53) MCL1KMT2AMEN1
SCHEMBL3498867 0.83 KMT2A (0.53) MCL1KMT2AMEN1
SCHEMBL3499197 0.80 PPARA (0.44) ALDH1A1MCL1KMT2APOLBMEN1
SCHEMBL3499201 0.80 NAALAD2 (0.47) MCL1KMT2AMEN1
SCHEMBL3500038 0.79 PPID (0.38) ALDH1A1NPSR1TSHRFNTAFNTB

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 4 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
US-20100130737-A1 Regulating Agent of GPR34 Receptor Function TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-27 US disclosed
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 ALDH1A1 3047/4885NPSR1 101/4885USP2 3343/4885

“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.