SCHEMBL1382429

SCHEMBL1382429

COc1cc(-n2nc(C3CCNCC3)c3ncnc(N)c32)ccc1NC(=O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.54
CSF1R P07333 17/20 0.48
LCK P06239 1/20 0.47
SRC P12931 1/20 0.47
KDR P35968 1/20 0.47
LIMK1 P53667 1/20 0.47
LIMK2 P53671 1/20 0.47
TEK Q02763 1/20 0.47
FAAH O00519 1/20 0.43
MGLL Q99685 1/20 0.43

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
SCHEMBL7103188 0.86 EGFR (0.52) EGFRCSF1RLCKSRCKDR
SCHEMBL3124060 0.81 LCK (0.54) EGFRCSF1RLCKSRCLIMK1
SCHEMBL17665717 0.76 CSF1R (0.69) CSF1R
SCHEMBL17665420 0.76 CSF1R (0.80) CSF1R
SCHEMBL3108981 0.74 EGFR (0.53) EGFRCSF1R
SCHEMBL28953972 0.72 EGFR (0.47) EGFR
SCHEMBL22587605 0.68 NPC1 (0.42) FAAHMGLL
SCHEMBL9524227 0.68 NPC1 (0.56) LCKSRCKDRLIMK1LIMK2
SCHEMBL17665470 0.67 CSF1R (0.65) CSF1R
SCHEMBL2074490 0.66 SRC (0.61) EGFRCSF1RLCKSRCKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4707167-B2 2011-06-22 JP claimed
EP-1496910-A4 KINASE INHIBITORS ABBOTT LAB (US) 2006-03-29 EP claimed
EP-1496910-A1 KINASE INHIBITORS Abbott Laboratories (US) 2005-01-19 EP claimed
US-20030225098-A1 Kinase inhibitors ABBOTT LABORATORIES 2003-12-04 US claimed
US-20030199525-A1 Kinase inhibitors ABBOTT LABORATORIES 2003-10-23 US claimed
WO-2003080064-A1 KINASE INHIBITORS ABBOTT LABORATORIES (US) 2003-10-02 WO claimed
US-7829570-B2 Substituted 4-amino isoxazolo[5,4-d]pyrimidines as kinase inhibitors ABBOTT LABORATORIES (US) 2010-11-09 US disclosed
US-20100041676-A1 Kinase inhibitors ABBVIE INC. 2010-02-18 US disclosed
US-20030225098-A1 Kinase inhibitors ABBOTT LABORATORIES 2003-12-04 US disclosed
US-20030199525-A1 Kinase inhibitors ABBOTT LABORATORIES 2003-10-23 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 (3 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-20030199525-A1 Kinase inhibitors MAP3K19, MAP3K9, MAP3K1 EGFR 346/4885CSF1R 797/4885LCK 70/4885
US-20030225098-A1 Kinase inhibitors MAP3K19, MAP3K9, MAP3K1 EGFR 298/4885CSF1R 651/4885LCK 91/4885
US-20100041676-A1 Kinase inhibitors MAP3K19, MAP3K20, MAP3K6 EGFR 232/4885CSF1R 1208/4885LCK 82/4885

“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.