SCHEMBL760438

SCHEMBL760438

CC1(C)OB(c2ccc3ccn(CC(N)=O)c3c2)OC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.41
F11 P03951 3/20 0.39
F2 P00734 2/20 0.38
PRSS1 P07477 2/20 0.38
PRSS2 P07478 2/20 0.38
PRSS3 P35030 2/20 0.38
LIPG Q9Y5X9 4/20 0.37
CA1 P00915 3/20 0.37
CA2 P00918 3/20 0.37
CA9 Q16790 3/20 0.37
LPL P06858 3/20 0.37
CA12 O43570 1/20 0.37
CA3 P07451 1/20 0.37
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 1/20 0.37
CA7 P43166 1/20 0.37
CA14 Q9ULX7 1/20 0.37
CA5B Q9Y2D0 1/20 0.37
ROCK1 Q13464 1/20 0.37

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
SCHEMBL762261 0.90 F11 (0.39) IRAK4F11F2PRSS1PRSS2
SCHEMBL20612087 0.82 KDM4E (0.57) IRAK4KDM4EALDH1A1POLBHPGD
SCHEMBL18230142 0.81 IRAK4 (0.43) IRAK4F11LIPGLPLROCK1
SCHEMBL18239698 0.79 LPL (0.44) IRAK4F11LIPGLPLMTNR1A
SCHEMBL20605103 0.79 KMT2A (0.48) F11F2PRSS1PRSS2PRSS3
SCHEMBL20612447 0.76 NOTUM (0.46) IRAK4F11F2PRSS1PRSS2
SCHEMBL20612398 0.76 HTR2A (0.53) IRAK4LIPGLPL
SCHEMBL18239405 0.76 IRAK4 (0.40) IRAK4LIPGLPLMTNR1AMTNR1B
SCHEMBL18239357 0.76 HTR6 (0.48) IRAK4LIPGLPL
SCHEMBL20604867 0.76 GRIN2B (0.40)

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-20120053345-A1 Indazole Compounds ABBOTT LABORATORIES (US) 2012-03-01 US disclosed
US-8008481-B2 Indazole compounds ABBVIE INC. 2011-08-30 US disclosed
US-20070282101-A1 Indazole compounds ABBVIE INC. 2007-12-06 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 (2 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-20070282101-A1 Indazole compounds CYP3A43, CYP3A7, UGT1A1 IRAK4 3595/4885F11 1993/4885F2 2314/4885
US-20120053345-A1 Indazole Compounds CYP3A43, CYP3A7, UGT1A1 IRAK4 3595/4885F11 1993/4885F2 2314/4885

“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.