SCHEMBL7088052

SCHEMBL7088052

Cc1csc(-c2cccc(C(=O)C(=O)c3ccccc3)c2-c2ccc(Br)s2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 4/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
CES2 O00748 3/20 0.35
CES1 P23141 3/20 0.35
EIF4E P06730 1/20 0.34
POLB P06746 4/20 0.32
ALDH1A1 P00352 1/20 0.32
MYC P01106 1/20 0.32
KDM4E B2RXH2 2/20 0.31
ABL1 P00519 1/20 0.31
LMNA P02545 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
SLC6A7 Q99884 1/20 0.30
CASP3 P42574 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 1/20 0.30

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
SCHEMBL7089313 0.82 RXFP1 (0.33) RXFP1KMT2AMEN1CES2CES1
SCHEMBL7090554 0.77 NPSR1 (0.37) KMT2AMEN1CES2CES1POLB
SCHEMBL7089408 0.75 PTGS2 (0.43) KDM4E
SCHEMBL7133865 0.75 RAB9A (0.46) KMT2AMEN1CES2CES1ALDH1A1
SCHEMBL7091527 0.72 TNFRSF1A (0.36) KMT2AMEN1ALDH1A1KDM4E
SCHEMBL7085577 0.72 CES2 (0.49) KMT2AMEN1CES2CES1POLB
SCHEMBL7089403 0.71 ADORA3 (0.45) KMT2ACES2CES1ALDH1A1KDM4E
SCHEMBL28864485 0.66 CES2 (0.41) CES2CES1NPC1RAB9A
SCHEMBL20815708 0.64 ALDH1A1 (0.56) RXFP1KMT2AMEN1EIF4EALDH1A1
SCHEMBL7091319 0.64 TTR (0.34) POLBMYCKDM4ENPC1MAPT

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
US-20030050330-A1 4,5-subtstituted imdazolyl compounds for the treatment of inflammation G.D. SEARLE & CO. 2003-03-13 US disclosed
US-6426360-B1 ANTIARTHRITIC AGENTS G D SEARLE & CO. 2002-07-30 US disclosed
EP-0772601-A1 4,5-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1997-05-14 EP disclosed
WO-1996003387-A1 4,5-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 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-20030050330-A1 4,5-subtstituted imdazolyl compounds for the treatment of inflammation AHR, HACL2, IRAK2 RXFP1 2420/4885KMT2A 2522/4885MEN1 4791/4885

“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.