SCHEMBL5409909

SCHEMBL5409909

O=C(Nc1ccc(Oc2ccccc2)cc1)NC(C(=O)NCCN1CCCC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 9/20 0.56
▸ MCHR2 Q969V1 3/20 0.56
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ POLB P06746 1/20 0.55
▸ ALDH1A1 P00352 1/20 0.51
▸ GLA P06280 1/20 0.51
▸ RAF1 P04049 1/20 0.51
▸ EPHX2 P34913 3/20 0.50
▸ CNR1 P21554 1/20 0.48
▸ CHRM4 P08173 1/20 0.48

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
SCHEMBL5406828 0.89 HTR3A (0.59) MCHR1MEN1KMT2APOLBEPHX2
SCHEMBL8297898 0.83 MEN1 (0.55) MCHR1MCHR2MEN1KMT2APOLB
SCHEMBL7255752 0.81 MCHR1 (0.79) MCHR1MCHR2MEN1KMT2APOLB
SCHEMBL8297628 0.76 MEN1 (0.55) MCHR1MCHR2MEN1KMT2APOLB
SCHEMBL5406900 0.75 DRD2 (0.53) MEN1KMT2APOLBALDH1A1
SCHEMBL5407347 0.75 SMN1; SMN2 (0.55) MCHR1MCHR2MEN1KMT2APOLB
SCHEMBL5407336 0.75 SMN1; SMN2 (0.55) MCHR1MCHR2MEN1KMT2APOLB
SCHEMBL6107774 0.75 MCHR1 (0.88) MCHR1MCHR2
SCHEMBL5411850 0.74 TACR2 (0.53) MCHR1MCHR2MEN1KMT2APOLB
SCHEMBL5414084 0.74 TACR2 (0.75) MCHR1MCHR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7202269-B2 GlyT2 modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-04-10 — — US claimed
US-20050119245-A1 GlyT2 modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2005-06-02 — — US claimed
US-7202269-B2 GlyT2 modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-04-10 — — US disclosed
US-7202269-B2 GlyT2 modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-04-10 — — US disclosed
US-7202269-B2 GlyT2 modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-04-10 — — US disclosed
US-20050119245-A1 GlyT2 modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2005-06-02 — — US disclosed
WO-2005044810-A1 GLYT2 MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2005-05-19 — — WO disclosed
WO-2005044810-A1 GLYT2 MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2005-05-19 — — 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-20050119245-A1 GlyT2 modulators GLRB, GLRA1, GLRA2 MCHR1 2851/4885MCHR2 2371/4885MEN1 1713/4885

“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.

Send feedback