SCHEMBL2442637

SCHEMBL2442637

COC(=O)c1cccc2c(=O)c3cc(I)ccc3[nH]c12

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.49
DHFR P00374 1/20 0.46
ABCG2 Q9UNQ0 5/20 0.44
PIM1 P11309 2/20 0.44
PIM3 Q86V86 2/20 0.44
MPL P40238 1/20 0.43
AKT1 P31749 7/20 0.43
FTO Q9C0B1 1/20 0.41
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL2441761 0.90 ABCG2 (0.50) PBRM1DHFRABCG2PIM1PIM3
SCHEMBL2440948 0.84 PBRM1 (0.69) PBRM1DHFRABCG2PIM1MPL
SCHEMBL2444761 0.84 PBRM1 (0.68) PBRM1DHFRABCG2PIM1PIM3
SCHEMBL2444383 0.81 PIM1 (0.51) PBRM1DHFRABCG2PIM1PIM3
SCHEMBL2445608 0.80 PIM1 (0.53) PBRM1DHFRABCG2PIM1PIM3
SCHEMBL20247450 0.80 PBRM1 (0.48) PBRM1DHFRABCG2KDM4EALDH1A1
SCHEMBL2449538 0.79 PBRM1 (0.51) PBRM1DHFRABCG2PIM1PIM3
SCHEMBL3234002 0.79 KIF11 (0.59) PBRM1DHFRABCG2PIM1PIM3
SCHEMBL12086512 0.77 KIF11 (0.51) PBRM1ABCG2KDM4EALDH1A1MAPT
SCHEMBL9485757 0.77 MPL (0.61) PBRM1PIM1PIM3MPLFTO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046789-B1 LABELLED ANALOGUES OF HALOBENZAMIDES AS RADIOPHARMACEUTICALS INST NAT SANTE RECH MED (FR) 2012-09-05 EP disclosed
EP-2363399-A1 Labelled analogues of halobenzamides as radiopharmaceuticals INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2011-09-07 EP disclosed
US-20100061928-A1 LABELLED ANALOGUES OF HALOBENZAMIDES AS RADIOPHARMACEUTICALS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2010-03-11 US disclosed
US-20100061928-A1 LABELLED ANALOGUES OF HALOBENZAMIDES AS RADIOPHARMACEUTICALS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2010-03-11 US disclosed
EP-2046789-A2 LABELLED ANALOGUES OF HALOBENZAMIDES AS RADIOPHARMACEUTICALS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2009-04-15 EP disclosed
WO-2008012782-A2 LABELLED ANALOGUES OF HALOBENZAMIDES AS RADIOPHARMACEUTICALS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2008-01-31 WO disclosed
WO-2008012782-A2 LABELLED ANALOGUES OF HALOBENZAMIDES AS RADIOPHARMACEUTICALS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2008-01-31 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-20100061928-A1 LABELLED ANALOGUES OF HALOBENZAMIDES AS RADIOPHARMACEUTICALS HRH3, H1-3, HRH4 PBRM1 287/4885DHFR 2610/4885ABCG2 993/4885

“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.