SCHEMBL3498352

SCHEMBL3498352

CC(C)Oc1ccc(-c2ccc3sc(C(=O)O)cc3c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.50
NR1H4 Q96RI1 1/20 0.49
RXRA P19793 1/20 0.48
RXRB P28702 1/20 0.48
KMT2A Q03164 1/20 0.46
BCL2L1 Q07817 1/20 0.45
PTGES O14684 1/20 0.45
F9 P00740 6/20 0.45
ALDH1A1 P00352 1/20 0.44
F10 P00742 3/20 0.44
CLK1 P49759 1/20 0.42
DYRK1A Q13627 1/20 0.42
DYRK1B Q9Y463 1/20 0.42
GPR35 Q9HC97 1/20 0.42
TBXAS1 P24557 1/20 0.41
FFAR4 Q5NUL3 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
SCHEMBL13344391 0.89 CLK1 (0.52) MCL1NR1H4RXRARXRBPTGES
SCHEMBL3496932 0.85 CLK1 (0.55) NR1H4BCL2L1F9F10CLK1
SCHEMBL3499504 0.84 F9 (0.47) MCL1NR1H4KMT2APTGESF9
SCHEMBL17858432 0.81 BCL2L1 (0.51) MCL1RXRARXRBKMT2ABCL2L1
SCHEMBL3497047 0.80 BCL2L1 (0.53) MCL1NR1H4KMT2ABCL2L1F9
SCHEMBL22777736 0.79 F9 (0.67) MCL1KMT2ABCL2L1F9F10
SCHEMBL121331 0.79 F9 (0.67) MCL1KMT2ABCL2L1F9F10
SCHEMBL3498109 0.79 F9 (0.50) NR1H4KMT2ABCL2L1F9F10
SCHEMBL3498018 0.77 BCL2L1 (0.53) NR1H4BCL2L1F9F10CLK1
SCHEMBL3499370 0.77 BCL2L1 (0.53) BCL2L1F9F10CLK1DYRK1A

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-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
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 MCL1 3727/4885NR1H4 25/4885RXRA 275/4885

“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.