SCHEMBL75515

SCHEMBL75515

CCOc1ccccc1C1(OC(=O)N2CCN(c3ccc(C#N)cn3)CC2)C(=O)N(S(=O)(=O)c2ccc(Cl)cc2)c2ccc(C#N)cc21

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 14/20 0.46
PANK3 Q9H999 1/20 0.40
SLC6A9 P48067 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CNR1 P21554 1/20 0.38
CYP3A4 P08684 1/20 0.38
TRPV4 Q9HBA0 1/20 0.37
CCR6 P51684 1/20 0.37

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
SCHEMBL4501988 0.90 AVPR1B (0.45) AVPR1BPANK3SLC6A9KDM4EALDH1A1
SCHEMBL75425 0.90 AVPR1B (0.55) AVPR1BPANK3SLC6A9KDM4EALDH1A1
SCHEMBL75454 0.89 AVPR1B (0.48) AVPR1BPANK3SLC6A9KDM4EALDH1A1
SCHEMBL75165 0.88 AVPR1B (0.48) AVPR1BPANK3SLC6A9KDM4EALDH1A1
SCHEMBL74334 0.88 AVPR1B (0.46) AVPR1BSLC6A9CYP3A4TRPV4
SCHEMBL4510754 0.87 AVPR1B (0.54) AVPR1BKDM4EALDH1A1LMNATSHR
SCHEMBL76769 0.85 AVPR1B (0.46) AVPR1BSLC6A9CYP3A4TRPV4CCR6
SCHEMBL74842 0.85 AVPR1B (0.61) AVPR1BSLC6A9SMN1; SMN2CYP3A4
SCHEMBL76860 0.84 AVPR1B (0.60) AVPR1BSLC6A9SMN1; SMN2CYP3A4
SCHEMBL74381 0.83 AVPR1B (0.59) AVPR1BSLC6A9SMN1; SMN2CYP3A4

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
US-8129389-B2 Substituted oxindole derivatives, medicaments containing the latter and use thereof ABBOTT GMBH & CO. KG (DE) 2012-03-06 US claimed
US-8129389-B2 Substituted oxindole derivatives, medicaments containing the latter and use thereof ABBOTT GMBH & CO. KG (DE) 2012-03-06 US disclosed
US-20090186904-A1 Substituted Oxindole Derivatives, Medicaments Containing the Latter and Use Thereof ABBOTT GMBH & CO. KG 2009-07-23 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-20090186904-A1 Substituted Oxindole Derivatives, Medicaments Containing the Latter and Use Thereof OXTR, AVPR2, AVPR1B AVPR1B 3/4885PANK3 3400/4885SLC6A9 2917/4885

“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.