SCHEMBL656917

SCHEMBL656917

O=C(CCc1ccc(Cl)cc1)c1ccccc1F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.51
SIGMAR1 Q99720 1/20 0.50
DRD2 P14416 1/20 0.49
ALDH1A1 P00352 3/20 0.49
CTNNB1 P35222 2/20 0.48
WNT3A P56704 2/20 0.48
GPR84 Q9NQS5 1/20 0.47
PDPK1 O15530 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
PTPN1 P18031 1/20 0.46
ERCC5 P28715 1/20 0.46
FEN1 P39748 1/20 0.46
ALOX15 P16050 1/20 0.46
PLAAT3 P53816 2/20 0.46
PLAAT5 Q96KN8 2/20 0.46
PLAAT2 Q9NWW9 2/20 0.46
PLAAT4 Q9UL19 2/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 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
SCHEMBL8956326 0.83 L3MBTL1 (0.54) SIGMAR1DRD2ALDH1A1MEN1KMT2A
SCHEMBL10988386 0.82 CYP19A1 (0.76) CYP19A1ALDH1A1GPR84PDPK1MEN1
SCHEMBL13988809 0.81 MEN1 (0.48) ALDH1A1MEN1KMT2AALOX15PLAAT3
SCHEMBL6203848 0.81 DRD2 (0.51) DRD2GPR84PLAAT3PLAAT5PLAAT2
SCHEMBL17952709 0.81 RAB9A (0.59) ALDH1A1MEN1KMT2APLAAT3PLAAT5
SCHEMBL3734285 0.81 PDPK1 (0.51) CYP19A1ALDH1A1CTNNB1WNT3APDPK1
SCHEMBL17451398 0.81 ALDH1A1 (0.47) ALDH1A1PDPK1MEN1KMT2APTPN1
SCHEMBL17451381 0.81 ALDH1A1 (0.47) ALDH1A1PDPK1MEN1KMT2APTPN1
SCHEMBL655754 0.80 PDPK1 (0.68) ALDH1A1PDPK1MEN1KMT2APLAAT3
SCHEMBL655753 0.80 PDPK1 (0.68) ALDH1A1PDPK1MEN1KMT2APLAAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2349999-B1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIV SAARLAND (DE) 2016-01-27 EP disclosed
US-8912186-B2 Allosteric protein kinase modulators UNIVERSITAET DES SAARLANDES (DE) 2014-12-16 US disclosed
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2012-02-23 US disclosed
EP-2177510-A1 Allosteric protein kinase modulators Universität des Saarlandes (DE) 2010-04-21 EP 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-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS AURKC, AURKA, AURKB CYP19A1 3058/4885SIGMAR1 4379/4885DRD2 4879/4885

“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.