SCHEMBL23312286

SCHEMBL23312286

COc1cc2c(cc1OC)CN(C(=O)NOCc1ccccc1)CC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 1/20 1.00
KMT2A Q03164 2/20 0.66
NPC1 O15118 2/20 0.66
THRB P10828 1/20 0.66
HCRTR2 O43614 8/20 0.60
POLB P06746 1/20 0.58
HCRTR1 O43613 2/20 0.58
KDM4E B2RXH2 2/20 0.57
HSD17B10 Q99714 2/20 0.57
ALOX15 P16050 1/20 0.57
ALDH1A1 P00352 2/20 0.56
TSHR P16473 1/20 0.56
MEN1 O00255 1/20 0.56
MAPT P10636 1/20 0.56
MDM2 Q00987 1/20 0.56
LMNA P02545 1/20 0.55
RAB9A P51151 1/20 0.55
CHRNA7 P36544 1/20 0.55

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
SCHEMBL5471336 0.82 KMT2A (0.70) GPR183KMT2ANPC1THRBHCRTR2
SCHEMBL9668362 0.81 CHRNA7 (0.69) GPR183KMT2ANPC1THRBHCRTR2
SCHEMBL9667825 0.81 CHRNA7 (0.69) GPR183KMT2ANPC1THRBHCRTR2
SCHEMBL18766747 0.78 HCRTR2 (0.70) GPR183KMT2ANPC1THRBHCRTR2
SCHEMBL5786994 0.77 GPR183 (0.63) GPR183KDM4EALDH1A1LMNA
SCHEMBL6326677 0.77 HCRTR2 (0.76) GPR183KMT2ANPC1HCRTR2HCRTR1
SCHEMBL6326918 0.77 HCRTR2 (0.76) GPR183KMT2ANPC1HCRTR2HCRTR1
SCHEMBL6324675 0.77 HCRTR2 (0.76) GPR183KMT2ANPC1HCRTR2HCRTR1
SCHEMBL3056571 0.77 KDM4E (0.69) GPR183KMT2ANPC1THRBHCRTR2
SCHEMBL4013019 0.76 GPR183 (0.62) GPR183KMT2ANPC1THRBHCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210122750-A1 GPR183 ANTAGONISTS FOR THE TREATMENT OF PAIN SAINT LOUIS UNIVERSITY 2021-04-29 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-20210122750-A1 GPR183 ANTAGONISTS FOR THE TREATMENT OF PAIN OPRL1, GPR183, GPR65 GPR183 2/4885KMT2A 4194/4885NPC1 977/4885

“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.