SCHEMBL4087244

SCHEMBL4087244

Brc1cc(OCc2ccccc2)cc2ccccc12.Oc1cc(Br)c2ccccc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 1/20 0.52
ALOX5 P09917 1/20 0.51
CYP1A2 P05177 2/20 0.49
CYP1A1 P04798 1/20 0.49
CYP19A1 P11511 1/20 0.49
LMNA P02545 1/20 0.46
PTGS1 P23219 1/20 0.46
SLC6A2 P23975 1/20 0.46
CYP2C19 P33261 1/20 0.46
PTGS2 P35354 1/20 0.46
SLC6A3 Q01959 1/20 0.46
HIF1A Q16665 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
MAOB P27338 5/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NQO2 P16083 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL4898966 0.93 ALOX5 (0.59) RHEBALOX5CYP1A2CYP1A1CYP19A1
SCHEMBL29418792 0.93 ALOX5 (0.59) RHEBALOX5CYP1A2CYP1A1CYP19A1
SCHEMBL29005956 0.81 MAOB (0.50) RHEBALOX5MAOB
SCHEMBL30049245 0.79 NQO2 (0.61) ALOX5CYP1A2CYP2C19HIF1AMEN1
SCHEMBL30643782 0.79 NQO2 (0.61) ALOX5CYP1A2CYP2C19HIF1AMEN1
SCHEMBL1055937 0.79 NQO2 (0.61) ALOX5CYP1A2CYP2C19HIF1AMEN1
SCHEMBL5255141 0.77 ALOX5 (0.50) RHEBALOX5CYP1A2CYP1A1CYP19A1
SCHEMBL4083845 0.76 PRMT5 (0.48) RHEBALOX5LMNAMAOBMEN1
SCHEMBL2424374 0.76 RHEB (0.48) RHEBALOX5MAOBMEN1KMT2A
SCHEMBL21822345 0.76 ALOX5 (0.57) RHEBALOX5CYP1A2CYP1A1CYP19A1

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-7534808-B2 Indolylmaleimide derivatives ELANCO TIERGESUNDHEIT AG (CH) 2009-05-19 US disclosed
US-7235555-B2 Indolylmaleimide derivatives NOVARTIS AG (CH) 2007-06-26 US disclosed
US-20050119274-A1 Indolylmaleimide derivatives NOVARTIS AG (CH) 2005-06-02 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-20050119274-A1 Indolylmaleimide derivatives MYLK2, DGKK, LCK RHEB 1021/4885ALOX5 2541/4885CYP1A2 4143/4885

“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.