SCHEMBL19988359

SCHEMBL19988359

COc1ccc(C2CCN(C(C)=O)C[C@H]2NC(=O)OC(C)(C)C)cc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FPR1 P21462 7/20 0.62
FPR2 P25090 5/20 0.62
KDM1A O60341 2/20 0.50
PDE4B Q07343 3/20 0.49
ALDH1A1 P00352 1/20 0.47
EPHX2 P34913 1/20 0.43
STS P08842 1/20 0.43
MAOB P27338 2/20 0.41
MAOA P21397 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TACR1 P25103 1/20 0.40

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
SCHEMBL19972322 0.85 FPR1 (0.67) FPR1FPR2KDM1AALDH1A1EPHX2
SCHEMBL20001240 0.82 FPR1 (0.64) FPR1FPR2PDE4B
SCHEMBL19988375 0.82 FPR1 (0.64) FPR1FPR2PDE4B
SCHEMBL18596569 0.79 KDM1A (0.76) KDM1APDE4BEPHX2MAOBMAOA
SCHEMBL15091431 0.79 KDM1A (0.76) KDM1APDE4BEPHX2MAOBMAOA
SCHEMBL15091433 0.79 KDM1A (0.76) KDM1APDE4BEPHX2MAOBMAOA
SCHEMBL19988380 0.78 FPR1 (0.63) FPR1FPR2KDM1APDE4BALDH1A1
SCHEMBL20001277 0.78 FPR1 (0.63) FPR1FPR2KDM1APDE4BALDH1A1
SCHEMBL19988741 0.77 FPR1 (0.80) FPR1FPR2
SCHEMBL19972388 0.77 FPR1 (0.74) FPR1FPR2EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10265310-B2 6-membered cyclic amines or lactames substituted with urea and phenyl Grünenthal GmbH (DE) 2019-04-23 US disclosed
WO-2018054549-A1 6-MEMBERED CYCLIC AMINES OR LACTAMES SUBSTITUTED WITH UREA AND PHENYL Grünenthal GmbH (DE) 2018-03-29 WO disclosed
US-20180078541-A1 6-MEMBERED CYCLIC AMINES OR LACTAMES SUBSTITUTED WITH UREA AND PHENYL Grünenthal GmbH (DE) 2018-03-22 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 (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-20180078541-A1 6-MEMBERED CYCLIC AMINES OR LACTAMES SUBSTITUTED WITH UREA AND PHENYL FPR2, FPR1, FPR3 FPR1 2/4885FPR2 1/4885KDM1A 4514/4885
US-10265310-B2 6-membered cyclic amines or lactames substituted with urea and phenyl FPR2, FPR1, FPR3 FPR1 2/4885FPR2 1/4885KDM1A 4514/4885

“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.