SCHEMBL2429818

SCHEMBL2429818

CC(C)(C)OC(=O)N1CCC2(C=C(c3cccc(C(F)(F)F)c3)CO2)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TACR1 P25103 1/20 0.45
▸ USP30 Q70CQ3 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ SCD5 Q86SK9 1/20 0.39
▸ SYK P43405 1/20 0.39
▸ TGFBR1 P36897 1/20 0.39
▸ GPR119 Q8TDV5 3/20 0.39
▸ POLB P06746 1/20 0.38
▸ NOTCH1 P46531 1/20 0.38
▸ RORC P51449 1/20 0.38
▸ STS P08842 1/20 0.38
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC2 Q92769 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
SCHEMBL19839770 0.85 SCD5 (0.47) TACR1USP30SCD5GPR119
SCHEMBL30835857 0.82 MAPT (0.43) TACR1USP30MAPTSCD5GPR119
SCHEMBL20396116 0.80 IDH1 (0.52) TACR1USP30GPR119RORC
SCHEMBL2424711 0.79 YAP1 (0.46) TACR1USP30SCD5GPR119
SCHEMBL20395989 0.77 PDK2 (0.41) TACR1MAPTGPR119RORC
SCHEMBL20412572 0.76 GRM5 (0.45) SCD5GPR119POLB
SCHEMBL19838850 0.75 SCD5 (0.44) USP30SCD5GPR119RORCHDAC1
SCHEMBL20396121 0.74 PARP14 (0.45) USP30SCD5GPR119HDAC1HDAC2
SCHEMBL13660794 0.74 TACR1 (0.56) TACR1
SCHEMBL13551815 0.74 TACR1 (0.45) TACR1USP30MAPTRXFP1SCD5

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-20110230493-A1 1-OXA-8-Azaspiro [4,5] Decabe-8-Carboxamide Compounds as FAAH Inhibitors PFIZER INC. 2011-09-22 — — 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-20110230493-A1 1-OXA-8-Azaspiro [4,5] Decabe-8-Carboxamide Compounds as FAAH Inhibitors FAAH, FAAH2, FFAR1 TACR1 1103/4885USP30 1277/4885MAPT 1995/4885

“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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