SCHEMBL5424481

SCHEMBL5424481

COc1ccccc1C1(OC(=O)N2CCN(C3CCN(C)CC3)CC2)C(=O)N(S(=O)(=O)c2cccc3cccnc23)c2ccc(Cl)cc21

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 13/20 0.54
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
OXTR P30559 1/20 0.42
AVPR1A P37288 1/20 0.42
MAPT P10636 2/20 0.41
HPGD P15428 1/20 0.40
MAPK1 P28482 2/20 0.40
LMNA P02545 1/20 0.40
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL1466224 0.98 AVPR1B (0.53) AVPR1BALDH1A1MEN1KMT2AOXTR
SCHEMBL1466321 0.94 AVPR1B (0.47) AVPR1BALDH1A1MEN1KMT2AOXTR
SCHEMBL1465084 0.93 AVPR1B (0.59) AVPR1BALDH1A1MEN1KMT2AOXTR
Hydrochloric Acid SCHEMBL1465353 0.92 AVPR1B (0.54) AVPR1BALDH1A1MEN1KMT2AOXTR
SCHEMBL1464977 0.89 AVPR1B (0.60) AVPR1BALDH1A1MEN1KMT2AOXTR
SCHEMBL1466418 0.88 AVPR1B (0.49) AVPR1BALDH1A1MEN1KMT2AMAPT
SCHEMBL1464290 0.88 AVPR1B (0.56) AVPR1BALDH1A1OXTRAVPR1AMAPT
SCHEMBL1795556 0.88 AVPR1B (0.43) AVPR1BALDH1A1KMT2AOXTRAVPR1A
SCHEMBL1465359 0.87 AVPR1B (0.58) AVPR1BMEN1KMT2AOXTRAVPR1A
SCHEMBL1464848 0.87 AVPR1B (0.57) AVPR1BALDH1A1OXTRAVPR1AMAPT

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
EP-1667993-B1 HETEROARYL-SUBSTITUTED 1,3-DIHYDROINDOL-2-ONE DERIVATIVES AND MEDICAMENTS CONTAINING THEM ABBVIE DEUTSCHLAND (DE) 2015-07-01 EP claimed
US-20070021607-A1 Heteroaryl-substituted 1,3-dihydroindol-2-one derivatives and medicaments containing them ABBOTT GMBH & CO. KG. 2007-01-25 US disclosed
US-20050070718-A1 Heteroaryl-substituted 1,3-dihydroindol-2-one derivatives and medicaments containing them ABBOTT GMBH & CO. KG 2005-03-31 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 (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-20050070718-A1 Heteroaryl-substituted 1,3-dihydroindol-2-one derivatives and medicaments containing them OXTR, AVPR2, AVPR1A AVPR1B 4/4885ALDH1A1 886/4885MEN1 259/4885
US-20070021607-A1 Heteroaryl-substituted 1,3-dihydroindol-2-one derivatives and medicaments containing them OXTR, AVPR2, AVPR1A AVPR1B 4/4885ALDH1A1 886/4885MEN1 259/4885

“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.