SCHEMBL6256743

SCHEMBL6256743

O=C(O)c1ccc(CCCc2ccccc2Cc2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 1/20 0.63
PTGER4 P35408 1/20 0.63
PTGER3 P43115 1/20 0.63
PTGER2 P43116 1/20 0.63
TSHR P16473 2/20 0.61
HDAC8 Q9BY41 1/20 0.53
RARB P10826 6/20 0.49
SRD5A2 P31213 1/20 0.49
BID P55957 1/20 0.48
BCL2L1 Q07817 1/20 0.48
MCL1 Q07820 1/20 0.48
BAK1 Q16611 1/20 0.48
HDAC1 Q13547 2/20 0.47
HTR2A P28223 1/20 0.47
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
RARA P10276 1/20 0.46
MAPT P10636 1/20 0.46
MTOR P42345 1/20 0.46
KMT2A Q03164 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
SCHEMBL6260223 0.90 PTGER4 (0.67) PTGER1PTGER4PTGER3PTGER2TSHR
SCHEMBL1982703 0.86 HDAC8 (0.67) PTGER1PTGER4PTGER3PTGER2TSHR
SCHEMBL9511673 0.83 RARB (0.61) TSHRRARBBIDBCL2L1MCL1
SCHEMBL6260082 0.83 TSHR (0.58) PTGER1PTGER4PTGER3PTGER2TSHR
SCHEMBL1980515 0.82 RARB (0.65) PTGER1PTGER4PTGER3PTGER2HDAC8
SCHEMBL8319817 0.82 PTGER1 (0.61) PTGER1PTGER4PTGER3PTGER2TSHR
SCHEMBL2743520 0.81 HDAC1 (0.68) PTGER1PTGER4PTGER3PTGER2HDAC8
SCHEMBL2402134 0.81 HDAC1 (0.68) PTGER1PTGER4PTGER3PTGER2HDAC8
SCHEMBL6263046 0.81 PTGER1 (0.59) PTGER1PTGER4PTGER3PTGER2TSHR
SCHEMBL8744299 0.81 PTGER1 (0.59) PTGER1PTGER4PTGER3PTGER2TSHR

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-0752421-B1 Ortho-substituted aromatic compounds, containing three (het)aryl moieties, their preparation and their use as prostaglandin E2-(PGE2)-antagonists ASTRAZENECA AB (SE) 2005-10-12 EP disclosed
US-6787562-B2 ANALGESICS; OSTEOPOROSIS ZENECA LTD. (GB) 2004-09-07 US disclosed
US-20030139418-A1 Substituted aryl and heteroaryl compounds as E-type prostaglandin antagonists SYNGENTA LIMITED (GB) 2003-07-24 US disclosed
US-6057345-A ANTAGONISTS OF THE PAIN ENHANCING EFFECTS OF E-TYPE PROSTAGLANDINS; USED IN PAIN RELIEF ZENECA LIMITED (GB) 2000-05-02 US disclosed
EP-0752421-A1 Ortho-substituted aromatic compounds, containing three (het)aryl moieties, their preparation and their use as prostaglandin E2-(PGE2)-antagonists ZENECA LIMITED (GB) 1997-01-08 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-20030139418-A1 Substituted aryl and heteroaryl compounds as E-type prostaglandin antagonists PTGER1, PTGDR, PTGER2 PTGER1 1/4885PTGER4 4/4885PTGER3 7/4885

“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.