SCHEMBL6202811

SCHEMBL6202811

Cc1cc(C(=O)N2CCC(=O)Nc3ccccc32)ccc1C#N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 4/20 0.60
CRBN Q96SW2 2/20 0.52
SLC22A12 Q96S37 5/20 0.50
ALDH1A1 P00352 4/20 0.50
LMNA P02545 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
HTT P42858 2/20 0.46
MEN1 O00255 2/20 0.44
RAB9A P51151 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 2/20 0.44
USP2 O75604 1/20 0.44
MAPT P10636 1/20 0.44
TSHR P16473 1/20 0.44
CASP1 P29466 1/20 0.44
HBB P68871 1/20 0.44
HSD17B10 Q99714 1/20 0.44
BRD2 P25440 1/20 0.43
HPGD P15428 1/20 0.43
PAX8 Q06710 1/20 0.43

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
SCHEMBL5235559 0.82 AVPR1A (0.57) BRD4CRBNSLC22A12ALDH1A1LMNA
SCHEMBL6201929 0.81 BRD4 (0.60) BRD4CRBNALDH1A1LMNANPSR1
SCHEMBL6970210 0.80 BRD4 (0.59) BRD4CRBNALDH1A1LMNANPSR1
SCHEMBL1346034 0.77 SLC22A12 (0.61) SLC22A12TSHRSMN1; SMN2
SCHEMBL6966461 0.76 BRD4 (0.65) BRD4CRBNALDH1A1LMNANPSR1
SCHEMBL4831821 0.75 AVPR1A (0.68)
SCHEMBL6972632 0.74 BRD4 (0.61) BRD4CRBNALDH1A1LMNANPSR1
SCHEMBL7016623 0.74 BRD4 (0.63) BRD4CRBNALDH1A1LMNANPSR1
SCHEMBL18373754 0.73 NOTUM (0.55) BRD4SLC22A12ALDH1A1LMNAHTT
SCHEMBL5232249 0.73 SLC22A12 (0.46) SLC22A12TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1399436-B1 OXYTOCIN AGONISTS FERRING BV (NL) 2005-03-16 EP disclosed
US-20040235753-A1 Oxytocin agonists PITT GRAY ROBERT WILLIAM (GB) 2004-11-25 US disclosed
EP-1399436-A2 OXYTOCIN AGONISTS Ferring BV (NL) 2004-03-24 EP disclosed
WO-2003000692-A2 OXYTOCIN AGONISTS FERRING BV (NL) 2003-01-03 WO 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-20040235753-A1 Oxytocin agonists OXTR, GNRHR, PRLHR BRD4 3590/4885CRBN 3797/4885SLC22A12 1744/4885

“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.