SCHEMBL6484183

SCHEMBL6484183

COc1cc(-c2ccccc2C(F)(F)F)c(Cl)cc1C(=O)N1Cc2ccc(C(=O)N(C)C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)n2Cc2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 17/20 0.39
AVPR1A P37288 4/20 0.33
P2RX7 Q99572 1/20 0.31

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
SCHEMBL6476620 0.88 AVPR2 (0.44) AVPR2AVPR1A
SCHEMBL5787152 0.87 AVPR2 (0.43) AVPR2AVPR1AP2RX7
SCHEMBL5782602 0.83 AVPR2 (0.51) AVPR2AVPR1AP2RX7
SCHEMBL6475615 0.83 AVPR2 (0.38) AVPR2AVPR1A
SCHEMBL5891272 0.83 AVPR2 (0.37) AVPR2
SCHEMBL6484499 0.83 AVPR1A (0.38) AVPR2AVPR1A
SCHEMBL6482713 0.82 AVPR2 (0.38) AVPR2AVPR1A
SCHEMBL6487114 0.81 AVPR2 (0.43) AVPR2AVPR1A
SCHEMBL6486457 0.80 AVPR2 (0.46) AVPR2AVPR1A
SCHEMBL6482643 0.79 AVPR2 (0.39) AVPR2AVPR1A

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
US-6900200-B2 Tricyclic hydroxy carboxamides and derivatives thereof tocolytic oxytocin receptor antagonists WYETH (US) 2005-05-31 US claimed
US-20030018026-A1 Novel tricyclic hydroxy carboxamides and derivatives thereof tocolytic oxytocin receptor antagonists WYETH (US) 2003-01-23 US claimed
US-6900200-B2 Tricyclic hydroxy carboxamides and derivatives thereof tocolytic oxytocin receptor antagonists WYETH (US) 2005-05-31 US disclosed
US-20030018026-A1 Novel tricyclic hydroxy carboxamides and derivatives thereof tocolytic oxytocin receptor antagonists WYETH (US) 2003-01-23 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-20030018026-A1 Novel tricyclic hydroxy carboxamides and derivatives thereof tocolytic oxytocin receptor antagonists OXTR, OPRL1, HCRTR2 AVPR2 45/4885AVPR1A 30/4885P2RX7 471/4885

“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.