SCHEMBL4862586

SCHEMBL4862586

O=C(Nc1ccc(Cl)cc1Cl)N1CCCCc2ccccc21

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 2/20 0.59
TAS1R1 Q7RTX1 2/20 0.59
TAS1R2 Q8TE23 2/20 0.59
AVPR2 P30518 1/20 0.57
AVPR1A P37288 1/20 0.57
TP53 P04637 2/20 0.56
LMNA P02545 2/20 0.54
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
THRB P10828 1/20 0.53
USP2 O75604 1/20 0.52
SPR P35270 1/20 0.52

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
SCHEMBL4865033 0.91 TP53 (0.59) AVPR2AVPR1ATP53LMNAMEN1
SCHEMBL4870081 0.89 LMNA (0.53) AVPR2AVPR1ATP53LMNAMEN1
SCHEMBL4868401 0.88 THRB (0.59) TAS1R3TAS1R1TAS1R2AVPR2AVPR1A
SCHEMBL4869800 0.83 MAPT (0.67) AVPR2AVPR1ATP53LMNAMEN1
SCHEMBL4865606 0.82 MEN1 (0.52) TP53LMNAMEN1KMT2ATHRB
SCHEMBL14591852 0.82 THRB (0.54) TP53LMNAMEN1KMT2ATHRB
SCHEMBL4869507 0.82 MEN1 (0.54) TP53LMNAMEN1KMT2ATHRB
SCHEMBL4869819 0.82 THRB (0.56) AVPR2AVPR1ATP53LMNAMEN1
SCHEMBL4863845 0.82 MEN1 (0.67) TP53LMNAMEN1KMT2ATHRB
SCHEMBL4867520 0.81 LMNA (0.60) AVPR2AVPR1ATP53LMNAMEN1

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-7368444-B2 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-06 US claimed
US-7368444-B2 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-06 US disclosed
US-20050101600-A1 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 US disclosed
EP-1475368-A1 N-CARBAMOYL NITROGEN-CONTAINING FUSED RING COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-11-10 EP 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-20050101600-A1 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient CNR1, CNR2, NPSR1 TAS1R3 2047/4885TAS1R1 1743/4885TAS1R2 1582/4885

“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.