SCHEMBL2713325

SCHEMBL2713325

Cc1c(N2CCN(C(=O)O)CC2C)nc2cc(F)cc(F)c2c1Cl

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMO Q99835 6/20 0.37
ADAMTS5 Q9UNA0 4/20 0.36
MMP2 P08253 2/20 0.36
ADAM17 P78536 1/20 0.36
TRPV1 Q8NER1 6/20 0.35
CHRM1 P11229 1/20 0.35
LMNA P02545 1/20 0.34
MMP14 P50281 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL3788198 0.86 PIK3CA (0.42) ADAMTS5LMNAMAPT
SCHEMBL2712304 0.86 PIK3CA (0.42) ADAMTS5LMNAMAPT
SCHEMBL2732507 0.86 PIK3CA (0.42) ADAMTS5LMNAMAPT
SCHEMBL2123656 0.84 PIK3CA (0.41) TRPV1SMN1; SMN2
SCHEMBL2711374 0.80 TRPV1 (0.40) SMOTRPV1CHRM1MAPT
SCHEMBL2732511 0.78
SCHEMBL2732510 0.78
SCHEMBL248326 0.78 KMT2A (0.41) MAPTSMN1; SMN2
SCHEMBL2712183 0.78 ALK (0.37)
SCHEMBL17635535 0.77 PIK3CA (0.41) TRPV1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2445886-B1 4-AMINOQUINOLINE DERIVATIVES AS PI3K INHIBITORS AMGEN INC (US) 2016-03-30 EP disclosed
US-8940724-B2 Quinoline derivitives and their uses AMGEN INC. (US) 2015-01-27 US disclosed
EP-2445886-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen, Inc (US) 2012-05-02 EP disclosed
US-20100331293-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2010-12-30 US disclosed
WO-2010151791-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2010-12-29 WO 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-20100331293-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, MALT1, BCL9 SMO 582/4885ADAMTS5 3305/4885MMP2 3563/4885

“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.