SCHEMBL6489303

SCHEMBL6489303

CCOC(=O)n1ccc(I)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
F2 P00734 1/20 0.39
ALOX15 P16050 1/20 0.39
MEN1 O00255 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 2/20 0.38
LPO P22079 4/20 0.38
CYP1A2 P05177 2/20 0.38
LMNA P02545 1/20 0.38
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
PDE4A P27815 1/20 0.36
TSHR P16473 1/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
BCHE P06276 1/20 0.36
JMJD6 Q6NYC1 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL12126286 0.81 KMT2A (0.49) KMT2AF2MEN1HPGDMAPK1
SCHEMBL161442 0.80 KMT2A (0.48) KMT2AF2ALOX15MEN1HPGD
SCHEMBL3048673 0.80 KMT2A (0.48) KMT2AF2ALOX15MEN1HPGD
SCHEMBL10436784 0.77 KMT2A (0.56) KMT2AF2ALOX15MEN1HPGD
SCHEMBL22290467 0.76 CYP4F2 (0.48) KMT2AHPGDMAPK1CYP1A2CYP4F2
SCHEMBL29172719 0.75 KMT2A (0.44) KMT2AF2ALOX15MEN1HPGD
SCHEMBL18007539 0.73 F2 (0.58) KMT2AF2MEN1HPGDLMNA
SCHEMBL28891292 0.73 CYP4F2 (0.40) KMT2AHPGDCYP4F2CYP4A11SMN1; SMN2
SCHEMBL23320098 0.72
SCHEMBL4748490 0.70 KMT2A (0.52) KMT2AF2ALOX15MEN1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050032869-A1 Pyrazolyl-indole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PHARMACIA ITALIA S.P.A. (IT) 2005-02-10 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-20050032869-A1 Pyrazolyl-indole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K9, MAP3K20, MAP3K19 KMT2A 1158/4885F2 3877/4885ALOX15 3875/4885

“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.