SCHEMBL19601922

SCHEMBL19601922

CC(OC(=O)N1CCC2(CCCN2Cc2ccc(Cl)cc2N2CCC(NS(C)(=O)=O)CC2)CC1)C(F)(F)F

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 10/20 0.55
PLA2G7 Q13093 1/20 0.46
ABHD6 Q9BV23 1/20 0.46

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
SCHEMBL19582565 0.93 MGLL (0.63) MGLLPLA2G7ABHD6
SCHEMBL19601933 0.92 MGLL (0.55) MGLL
SCHEMBL19601964 0.89 MGLL (0.60) MGLLPLA2G7ABHD6
SCHEMBL19601932 0.88 MGLL (0.60) MGLLPLA2G7ABHD6
SCHEMBL19601961 0.88 MGLL (0.60) MGLLPLA2G7ABHD6
SCHEMBL19601977 0.87 MGLL (0.71) MGLL
SCHEMBL19601904 0.87 MGLL (0.58) MGLLPLA2G7ABHD6
SCHEMBL19601946 0.87 MGLL (0.54) MGLLPLA2G7ABHD6
SCHEMBL19601924 0.87 MGLL (0.60) MGLLPLA2G7ABHD6
SCHEMBL19601953 0.87 MGLL (0.60) MGLLPLA2G7ABHD6

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-10030020-B2 Spirocycle compounds and methods of making and using same ABIDE THERAPEUTICS, INC. (US) 2018-07-24 US disclosed
US-20170327500-A1 SPIROCYCLE COMPOUNDS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2017-11-16 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 (2 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-20170327500-A1 SPIROCYCLE COMPOUNDS AND METHODS OF MAKING AND USING SAME ABHD6, ABHD16A, ACSL6 MGLL 24/4885PLA2G7 305/4885ABHD6 1/4885
US-10030020-B2 Spirocycle compounds and methods of making and using same ABHD6, ABHD16A, ACSL6 MGLL 24/4885PLA2G7 305/4885ABHD6 1/4885

“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.