SCHEMBL4052652

SCHEMBL4052652

COc1cccc(-c2nc(Cl)ccc2CC(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.47
KMT2A Q03164 1/20 0.46
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
THRA P10827 1/20 0.45
THRB P10828 1/20 0.45
HSD17B10 Q99714 3/20 0.45
RECQL P46063 1/20 0.44
KDM4E B2RXH2 1/20 0.44
USP2 O75604 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GRK6 P43250 1/20 0.44
VDR P11473 1/20 0.43
PPARD Q03181 1/20 0.43
CTSA P10619 1/20 0.43
MAPK1 P28482 2/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 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
SCHEMBL4166291 0.80 KCNA5 (0.59) PTGDR2KMT2ARXRARXRBHSD17B10
SCHEMBL4156618 0.78 KMT2A (0.52) KMT2AHSD17B10RECQLKDM4EUSP2
SCHEMBL6856938 0.76 PTGDR2 (0.44) PTGDR2RXRARXRBHSD17B10RECQL
SCHEMBL4052629 0.76 GAPDH (0.46) KMT2AHSD17B10ALDH1A1HPGDSMN1; SMN2
SCHEMBL23703568 0.72 HSD17B10 (0.41) PTGDR2HSD17B10
SCHEMBL4207967 0.71 PTGS1 (0.59) THRATHRBUSP2VDRPPARD
SCHEMBL473881 0.70 HSD17B10 (0.63) KMT2ATHRBHSD17B10RECQLKDM4E
SCHEMBL4055913 0.70 LMNA (0.46) KMT2ARXRARXRBTHRATHRB
SCHEMBL4405072 0.70 CYP1A2 (0.53) KMT2AHSD17B10KDM4EALDH1A1HPGD
SCHEMBL4206771 0.70 SLC13A5 (0.61) RXRARXRBVDRPPARDLMNA

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-20090209571-A1 Phenanthrene derivatives as MPGES-1 inhibitors CELLUMEN INC. 2009-08-20 US disclosed
EP-2024371-A1 PHENANTHRENE DERIVATIVES AS MPGES-1 INHIBITORS Merck Frosst Canada Ltd. (CA) 2009-02-18 EP disclosed
WO-2007134434-A1 PHENANTHRENE DERIVATIVES AS MPGES-1 INHIBITORS MERCK FROSST CANADA LTD. (CA) 2007-11-29 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-20090209571-A1 Phenanthrene derivatives as MPGES-1 inhibitors PTGES, PTGS1, PTGES2 PTGDR2 37/4885KMT2A 2400/4885RXRA 1270/4885

“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.