SCHEMBL15181971

SCHEMBL15181971

COc1cccc([C@H]2[C@H](CN3CCC(C(=O)O)CC3)OC(=O)N2c2ccc(Cl)cc2)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.41
DRD2 P14416 4/20 0.39
DRD4 P21917 4/20 0.38
CCR2 P41597 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAPT P10636 1/20 0.38
PMP22 Q01453 1/20 0.38
ACKR3 P25106 1/20 0.38
SIGMAR1 Q99720 2/20 0.38
CCR5 P51681 1/20 0.38
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37

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
SCHEMBL15181970 0.93 MGLL (0.41) MGLLDRD2DRD4CCR2MEN1
SCHEMBL3586744 0.90 ALDH1A1 (0.51) MEN1KMT2AMAPTCCR5
SCHEMBL15182313 0.87 CHRNA7 (0.48) DRD2MAPTSIGMAR1
SCHEMBL3587813 0.85 TP53 (0.44) DRD2DRD4KMT2ACYP1A2CYP3A4
SCHEMBL3596801 0.83 DRD4 (0.40) DRD2DRD4CYP1A2CYP3A4CYP2D6
SCHEMBL3596254 0.83 KMT2A (0.46) DRD2DRD4MEN1KMT2AMAPT
SCHEMBL3594104 0.83 ALDH1A1 (0.39) DRD2DRD4CYP1A2CYP3A4CYP2D6
SCHEMBL3594022 0.83 CNR1 (0.46) DRD2DRD4MEN1KMT2ACYP1A2
SCHEMBL3588686 0.83 KDM4E (0.46) DRD2DRD4MEN1KMT2ACYP1A2
SCHEMBL3593261 0.82 DRD2 (0.39) DRD2CCR2MAPTSIGMAR1

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-20130210769-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2013-08-15 US disclosed
US-20130210769-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2013-08-15 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-20130210769-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY CNR1, CNR2, FAAH MGLL 197/4885DRD2 889/4885DRD4 1876/4885

“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.