SCHEMBL3497386

SCHEMBL3497386

CCOC(=O)c1cn2cc(-c3ccc(Cl)cc3)cnc2n1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 10/20 0.57
GABRB2 P47870 10/20 0.57
ALDH1A1 P00352 3/20 0.54
KDM4E B2RXH2 3/20 0.54
HPGD P15428 2/20 0.54
PTGS2 P35354 1/20 0.49
GRM5 P41594 1/20 0.49
LMNA P02545 2/20 0.48
MAPT P10636 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
IDO1 P14902 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
POLB P06746 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TARBP2 Q15633 1/20 0.44

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
SCHEMBL22577081 0.85 KDM4E (0.61) GABRA2GABRB2ALDH1A1KDM4EHPGD
SCHEMBL3499130 0.83 GABRA2 (0.62) GABRA2GABRB2KDM4EPTGS2POLB
SCHEMBL21033491 0.82 KDM4E (0.55) GABRA2GABRB2ALDH1A1KDM4EHPGD
SCHEMBL3500124 0.81 GRM5 (0.53) GABRA2GABRB2GRM5SMN1; SMN2
SCHEMBL21639355 0.80 ALDH1A1 (0.53) GABRA2GABRB2ALDH1A1KDM4EHPGD
SCHEMBL21688698 0.79 KDM4E (0.64) GABRA2GABRB2ALDH1A1KDM4EHPGD
SCHEMBL21012007 0.79 KDM4E (0.52) GABRA2GABRB2ALDH1A1KDM4EHPGD
SCHEMBL3500116 0.79 GABRA2 (0.57) GABRA2GABRB2ALDH1A1KDM4EHPGD
SCHEMBL31035692 0.77 KDM4E (0.61) GABRA2GABRB2ALDH1A1KDM4EHPGD
SCHEMBL21004926 0.77 KDM4E (0.61) GABRA2GABRB2ALDH1A1KDM4EHPGD

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 GABRA2 317/4885GABRB2 169/4885ALDH1A1 3047/4885

“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.