SCHEMBL3626959

SCHEMBL3626959

O=C(O)N(Cc1ccc(-c2cc3nccc(Cl)c3s2)cc1)CC1CCCO1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.47
▸ OXTR P30559 12/20 0.47
▸ AVPR1A P37288 8/20 0.47
▸ TP53 P04637 3/20 0.45
▸ GAA P10253 2/20 0.43
▸ MRGPRX1 Q96LB2 1/20 0.43
▸ MAPT P10636 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
SCHEMBL3565103 0.89 POLB (0.45) POLBOXTRAVPR1ATP53GAA
SCHEMBL3565107 0.81 STK17B (0.38) POLBOXTRAVPR1A
SCHEMBL5089101 0.79 STK17B (0.36) POLBOXTRAVPR1AGAA
SCHEMBL3567825 0.79 MET (0.42) OXTRAVPR1A
SCHEMBL3567819 0.79 MET (0.42) OXTRAVPR1A
SCHEMBL1337005 0.75 NPC1 (0.59) POLBOXTRAVPR1AGAA
Hydrochloric Acid SCHEMBL1336911 0.74 NPC1 (0.58) POLBOXTRAVPR1AGAA
SCHEMBL15225861 0.73 HTT (0.41) POLBTP53MAPT
SCHEMBL3575864 0.73 MET (0.68) —
SCHEMBL13166773 0.72 MET (0.41) OXTRAVPR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8470850-B2 Inhibitors of VEGF receptor and HGF receptor signalling METHYLGENE INC. (CA) 2013-06-25 — — US disclosed
US-20100216766-A1 Inhibitors of VEGF Receptor and HGF Receptor Signalling 92229129 QUEBEC INC. (CA) 2010-08-26 — — 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-20100216766-A1 Inhibitors of VEGF Receptor and HGF Receptor Signalling HGF, MET, FLT1 POLB 1354/4885OXTR 943/4885AVPR1A 560/4885

“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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