SCHEMBL20101180

SCHEMBL20101180

CC(C)(C)OC(=O)N1CC(C(O)c2cc(Br)ccc2F)C1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.53
DPP4 P27487 1/20 0.43
MAP3K14 Q99558 2/20 0.41
GPR119 Q8TDV5 2/20 0.40
RORC P51449 3/20 0.40
FPR2 P25090 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP3A5 P20815 1/20 0.38
PDE4B Q07343 1/20 0.38
IDO1 P14902 2/20 0.38
FPR3 P25089 1/20 0.38
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
TRPV3 Q8NET8 1/20 0.37
AAK1 Q2M2I8 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
SCHEMBL31602711 0.83 GPR119 (0.45) USP30DPP4MAP3K14GPR119RORC
SCHEMBL18249669 0.82 GPR119 (0.47) USP30DPP4MAP3K14GPR119RORC
SCHEMBL20164096 0.81 GPR119 (0.45) USP30DPP4MAP3K14GPR119CYP3A4
SCHEMBL24357345 0.80 RORC (0.46) USP30RORCFPR2PDE4BIDO1
SCHEMBL20164090 0.80 DPP4 (0.45) USP30DPP4MAP3K14GPR119RORC
SCHEMBL31521322 0.79 GPR119 (0.43) USP30DPP4MAP3K14GPR119RORC
SCHEMBL18249589 0.79 GPR119 (0.47) USP30DPP4MAP3K14GPR119RORC
SCHEMBL18249625 0.79 DPP4 (0.42) USP30DPP4MAP3K14GPR119PDE4B
SCHEMBL18249632 0.78 DPP4 (0.47) USP30DPP4MAP3K14GPR119RORC
SCHEMBL31602843 0.77 GPR119 (0.43) USP30DPP4MAP3K14GPR119RORC

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-20180118734-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2018-05-03 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-20180118734-A1 THERAPEUTIC COMPOUNDS NQO1, HAVCR2, CCR5 USP30 4687/4885DPP4 1591/4885MAP3K14 2717/4885

“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.