SCHEMBL2069345

SCHEMBL2069345

O=Cc1cccc(N2CCCC(OCc3ccc(-c4ccc(Cl)cc4)cc3)C2)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 10/20 0.51
DRD2 P14416 2/20 0.43
DRD3 P35462 2/20 0.43
KCNH2 Q12809 1/20 0.43
DRD4 P21917 3/20 0.39
NAAA Q02083 2/20 0.38
TMEM97 Q5BJF2 2/20 0.38
SIGMAR1 Q99720 2/20 0.38
DRD1 P21728 1/20 0.37
DRD5 P21918 1/20 0.37
CNR1 P21554 1/20 0.36
CARM1 Q86X55 1/20 0.36
PRMT6 Q96LA8 1/20 0.36
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
ITGB2 P05107 1/20 0.35
ICAM1 P05362 1/20 0.35
ITGAL P20701 1/20 0.35

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
SCHEMBL3892900 0.83 PPARA (0.76) PPARAPPARGPPARD
SCHEMBL12777927 0.81 NAAA (0.43) PPARADRD2DRD3KCNH2DRD4
SCHEMBL2070733 0.81 PPARA (0.61) PPARADRD2DRD3KCNH2CNR1
SCHEMBL2071181 0.76 PPARA (0.49) PPARADRD2DRD3KCNH2NAAA
SCHEMBL27553662 0.73 PPARA (0.42) PPARADRD2DRD3KCNH2DRD4
Hydrochloric Acid SCHEMBL2953978 0.70 SLC6A2 (0.46) PPARADRD2DRD3KCNH2NAAA
Hydrochloric Acid SCHEMBL2953980 0.70 SLC6A2 (0.46) PPARADRD2DRD3KCNH2NAAA
Hydrochloric Acid SCHEMBL2950320 0.69 SLC6A2 (0.43) PPARAKCNH2NAAASIGMAR1CARM1
Hydrochloric Acid SCHEMBL2950324 0.69 SLC6A2 (0.43) PPARAKCNH2NAAASIGMAR1CARM1
SCHEMBL12844587 0.69 BPTF (0.54) PPARADRD2DRD3DRD4DRD1

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-7902367-B2 Cyclic amino benzoic acid derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-03-08 US disclosed
US-20070249580-A1 Novel Cyclic Amino Benzoic Acid Derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2007-10-25 US 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-20070249580-A1 Novel Cyclic Amino Benzoic Acid Derivative PPARA, PPARG, PPARD PPARA 1/4885DRD2 1596/4885DRD3 1516/4885

“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.