SCHEMBL696163

SCHEMBL696163

[O]Cc1ccc(C(F)(F)F)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 13/20 0.53
DAO P14920 1/20 0.50
KDM1A O60341 1/20 0.41
P2RX7 Q99572 1/20 0.40
FFAR1 O14842 1/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38

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
SCHEMBL15860395 0.83 KIF11 (0.53) KIF11DAOKDM1AP2RX7FFAR1
SCHEMBL2642102 0.83 AR (0.48) KIF11P2RX7
SCHEMBL6745234 0.83 RXRA (0.49) KIF11DAORXRARXRBRXRG
SCHEMBL3637724 0.82 KIF11 (0.51) KIF11DAOKDM1AP2RX7FFAR1
SCHEMBL25738425 0.80 KIF11 (0.50) KIF11DAOKDM1AFFAR1CYP11B1
SCHEMBL12706035 0.79 KIF11 (0.53) KIF11DAOKDM1AP2RX7FFAR1
SCHEMBL19356858 0.79 KIF11 (0.53) KIF11DAOKDM1AP2RX7FFAR1
Bromide SCHEMBL582107 0.79 KIF11 (0.53) KIF11DAOKDM1AP2RX7FFAR1
SCHEMBL698164 0.79 KIF11 (0.53) KIF11DAOKDM1AP2RX7FFAR1
SCHEMBL297408 0.79 KIF11 (0.53) KIF11DAOKDM1A

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
EP-2421847-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP claimed
WO-2010124116-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO claimed
US-20020022604-A1 Polycyclic aryl and heteroaryl substituted 4-pyrones useful for selective inhibition of the coagulation cascade PHAMACIA CORPORATION 2002-02-21 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-20020022604-A1 Polycyclic aryl and heteroaryl substituted 4-pyrones useful for selective inhibition of the coagulation cascade TFPI, PLAT, F2 KIF11 4873/4885DAO 691/4885KDM1A 1937/4885

“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.