SCHEMBL2198449

SCHEMBL2198449

Cc1ccc(C(=O)N2CCOCC2)cc1C(=O)c1ccc(N)cc1Cl

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.64
PKM P14618 2/20 0.53
RAB9A P51151 1/20 0.50
GAA P10253 1/20 0.49
MYC P01106 1/20 0.47
PHGDH O43175 1/20 0.47
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 2/20 0.46
KMT2A Q03164 2/20 0.46
PDK1 Q15118 1/20 0.44
PDK2 Q15119 1/20 0.44
PDK3 Q15120 1/20 0.44
PDK4 Q16654 1/20 0.44
MAPT P10636 1/20 0.44
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
AKR1C3 P42330 1/20 0.43

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
SCHEMBL2197966 0.93 HPGD (0.63) HPGDPKMRAB9AGAAMYC
SCHEMBL2197823 0.88 POLB (0.48) HPGDGAAALDH1A1KMT2AMAPT
SCHEMBL2197834 0.81 ALDH1A1 (0.44) HPGDRAB9AGAAALDH1A1KMT2A
SCHEMBL4766465 0.80 MAPT (0.61) HPGDPKMGAAPHGDHKDM4E
SCHEMBL13161947 0.79 HPGD (1.00) HPGDPKMRAB9AGAAPHGDH
SCHEMBL2201614 0.78 CYP2C9 (0.56) ALDH1A1KMT2ATSHRSMN1; SMN2
SCHEMBL2198191 0.78 SRD5A2 (0.47) HPGDGAAALDH1A1KDM4EMAPT
SCHEMBL3226522 0.78 HPGD (0.68) HPGDPKMRAB9AGAAMYC
SCHEMBL3400224 0.78 HPGD (0.55) HPGDPKMGAAMYCALDH1A1
SCHEMBL17979877 0.78 MEN1 (0.55) HPGDPKMRAB9AGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1658263-B9 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA AS (DK) 2011-11-09 EP disclosed
US-7977387-B2 Aminobenzophenone compounds LEO PHARMA A/S (DK) 2011-07-12 US disclosed
CN-1826310-B Novel aminobenzophenone compounds LEO PHARMA AS 2010-07-21 CN disclosed
EP-1658263-B1 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA AS (DK) 2010-06-02 EP disclosed
CN-1826310-A Novel aminobenzophenone compounds LEO PHARMA AS (DK) 2006-08-30 CN disclosed
US-20060166990-A1 Novel aminobenzophenone compounds LEO PHARMA A/S (DK) 2006-07-27 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-20060166990-A1 Novel aminobenzophenone compounds NFKBIA, UACA, ALDH7A1 HPGD 1490/4885PKM 1027/4885RAB9A 1123/4885

“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.