SCHEMBL5377085

SCHEMBL5377085

OB(Oc1ccc(Cl)cc1)Oc1ccc(Br)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.43
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
TSHR P16473 1/20 0.38
ENPP2 Q13822 1/20 0.38
LMNA P02545 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPT P10636 2/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
LDHA P00338 1/20 0.34
CNR1 P21554 3/20 0.33
CYP2A6 P11509 2/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL6398321 0.89 ENPP2 (0.46) PPARACA1CA2TSHRENPP2
SCHEMBL5377020 0.81 ORAI1 (0.48) DRD4PPARGPPARACA1CA2
SCHEMBL635637 0.80 ENPP2 (0.46) PPARACA1CA2TSHRENPP2
SCHEMBL5376998 0.79 APP (0.48) PPARACA1CA2ENPP2LMNA
SCHEMBL28067243 0.78 ENPP2 (0.44) PPARACA1CA2ENPP2LMNA
SCHEMBL27557826 0.78 ENPP2 (0.44) PPARACA1CA2ENPP2LMNA
Potassium SCHEMBL1305608 0.78 ENPP2 (0.44) PPARACA1CA2ENPP2LMNA
Ammonia Solution, Strong SCHEMBL27844793 0.78 ENPP2 (0.44) PPARACA1CA2ENPP2LMNA
SCHEMBL2150297 0.77 CA2 (0.48) CA1CA2TSHRLMNAMEN1
SCHEMBL5388315 0.76 CYP1A2 (0.58) PPARGPPARACA1CA2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040259842-A1 Intracellular calcuim concentration increase inhibitors MIKOSHIBA, KATSUHIKO (JP) 2004-12-23 US claimed
EP-1444981-A1 INTRACELLULAR CALCIUM CONCENTRATION INCREASE INHIBITORS Mikoshiba, Katsuhiko (JP) 2004-08-11 EP claimed
US-20120316247-A1 PREVENTION AND TREATMENT OF POST-OPERATIVE COGNITIVE DYSFUNCTION (POCD) THE GENERAL HOSPITAL CORPORATION (US) 2012-12-13 US disclosed
US-7217701-B2 Intracellular calcium concentration increase inhibitors KATSUHIKO MIKOSHIBA (JP) 2007-05-15 US disclosed
US-20040259842-A1 Intracellular calcuim concentration increase inhibitors MIKOSHIBA, KATSUHIKO (JP) 2004-12-23 US disclosed
EP-1444981-A1 INTRACELLULAR CALCIUM CONCENTRATION INCREASE INHIBITORS Mikoshiba, Katsuhiko (JP) 2004-08-11 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 (2 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-20120316247-A1 PREVENTION AND TREATMENT OF POST-OPERATIVE COGNITIVE DYSFUNCTION (POCD) CHAT, ACHE, BCHE DRD4 179/4885PPARG 2429/4885PPARA 2829/4885
US-20040259842-A1 Intracellular calcuim concentration increase inhibitors CAB39, BPGM, ORAI1 DRD4 4767/4885PPARG 4153/4885PPARA 3996/4885

“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.