SCHEMBL8223179

SCHEMBL8223179

O=C(C1CCN(Cc2cncs2)CC1)N1CCN(Cc2ccccc2Br)CC1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.49
▸ HPGD P15428 1/20 0.49
▸ KDM4E B2RXH2 5/20 0.49
▸ ALDH1A1 P00352 4/20 0.49
▸ LMNA P02545 1/20 0.49
▸ KMT2A Q03164 5/20 0.47
▸ MEN1 O00255 4/20 0.47
▸ FAAH O00519 1/20 0.47
▸ RAB9A P51151 1/20 0.45
▸ ALOX15 P16050 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ ATM Q13315 1/20 0.42

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
SCHEMBL14456744 0.82 KMT2A (0.56) TSHRKDM4EALDH1A1LMNAKMT2A
SCHEMBL14456705 0.79 KDM4E (0.53) TSHRHPGDKDM4EALDH1A1LMNA
SCHEMBL8420394 0.79 KMT2A (0.55) TSHRHPGDKDM4EALDH1A1LMNA
SCHEMBL14456686 0.78 TSHR (0.48) TSHRHPGDKDM4EALDH1A1LMNA
SCHEMBL14456685 0.78 ALDH1A1 (0.57) TSHRHPGDKDM4EALDH1A1LMNA
SCHEMBL8230258 0.77 TSHR (0.49) TSHRHPGDKDM4EALDH1A1LMNA
SCHEMBL14456706 0.76 TSHR (0.48) TSHRHPGDKDM4EALDH1A1LMNA
SCHEMBL14456691 0.76 TSHR (0.48) TSHRHPGDKDM4EALDH1A1LMNA
SCHEMBL8223139 0.76 TSHR (0.48) TSHRHPGDKDM4EALDH1A1LMNA
SCHEMBL8228144 0.76 KMT2A (0.54) TSHRHPGDKDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007075555-A2 COMBINATION OF AN H3 ANTAGONIST/INVERSE AGONIST AND AN APPETITE SUPPRESSANT SCHERING CORPORATION (US) 2007-07-05 — — WO disclosed
US-7238688-B2 Piperidine compounds SCHERING CORPORATION (US) 2007-07-03 — — US disclosed
US-7238688-B2 Piperidine compounds SCHERING CORPORATION (US) 2007-07-03 — — US disclosed
US-20070142369-A1 Combination of an H3 antagonist/inverse agonist and an appetite suppressant SCHERING CORPORATION 2007-06-21 — — US disclosed
US-20070142369-A1 Combination of an H3 antagonist/inverse agonist and an appetite suppressant SCHERING CORPORATION 2007-06-21 — — 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-20070142369-A1 Combination of an H3 antagonist/inverse agonist and an appetite suppressant CNR2, GPR119, GLP1R TSHR 396/4885HPGD 929/4885KDM4E 199/4885

“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.

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