SCHEMBL3276936

SCHEMBL3276936

Clc1ccc2c(c1Nc1ncnc3cc(OCCN4CCCC4)cc(N4CCOCC4)c13)OCO2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 19/20 1.00
KDR P35968 12/20 1.00
CSK P41240 4/20 0.69
EGFR P00533 2/20 0.69
LCK P06239 2/20 0.69
YES1 P07947 2/20 0.69
FGFR1 P11362 1/20 0.69
AURKB Q96GD4 1/20 0.69
EPHB4 P54760 2/20 0.66
PKMYT1 Q99640 2/20 0.66
BMPR1B O00238 1/20 0.66
GAK O14976 1/20 0.66
EPHB6 O15197 1/20 0.66
RIPK2 O43353 1/20 0.66
STK10 O94804 1/20 0.66
MAP4K4 O95819 1/20 0.66
ABL1 P00519 1/20 0.66
FYN P06241 1/20 0.66
LYN P07948 1/20 0.66
RET P07949 1/20 0.66

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
SCHEMBL3202847 0.85 SRC (1.00) SRCKDRCSKEGFRLCK
SCHEMBL3206728 0.84 SRC (0.99) SRCKDRCSKEGFRLCK
SCHEMBL3192019 0.82 SRC (0.90) SRCKDRCSKEGFRLCK
SCHEMBL3205977 0.81 SRC (1.00) SRCKDRCSKEGFRLCK
SCHEMBL3274654 0.81 SRC (0.99) SRCKDRCSKEGFRLCK
Saracatinib SCHEMBL41547 0.80 SRC (1.00) SRCKDRCSKEGFRLCK
Saracatinib SCHEMBL29380648 0.80 SRC (1.00) SRCKDRCSKEGFRLCK
Saracatinib SCHEMBL29357263 0.80 SRC (1.00) SRCKDRCSKEGFRLCK
Saracatinib SCHEMBL29487213 0.80 SRC (1.00) SRCKDRCSKEGFRLCK
Saracatinib SCHEMBL4255230 0.79 SRC (0.99) SRCKDRCSKEGFRLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100280042-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF TUMOURS HENNEQUIN LAURENT FRANCOIS ANDRE 2010-11-04 US disclosed
US-7696214-B2 Quinazoline derivatives for the treatment of tumours ASTRAZENECA AB (SE) 2010-04-13 US disclosed
US-7160891-B2 Quinazoline derivatives for the treatment of T cell mediated diseases ASTRAZENECA AB (SE) 2007-01-09 US disclosed
US-20060258642-A1 Quinazoline derivatives for the treatment of tumours ASTRAZENECA AB 2006-11-16 US disclosed
US-7049438-B2 Quinazoline derivatives for treatment of tumours ASTRAZENECA AB (SE) 2006-05-23 US disclosed
EP-1450808-B1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF T CELL MEDIATED DISEASES ASTRAZENECA AB (SE) 2005-06-15 EP disclosed
US-20050038050-A1 Quinazoline derivatives for the treatment of t cell mediated diseases ASTRAZENECA AB (SE) 2005-02-17 US disclosed
US-20040214841-A1 Quinazoline derivatives for treatment of tumours ASTRAZENECA AB (SE) 2004-10-28 US disclosed
EP-1292594-B1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF TUMOURS ASTRAZENECA AB (SE) 2004-09-01 EP disclosed
WO-2001094341-A9 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF TUMOURS ASTRAZENECA AB (SE) 2003-04-17 WO disclosed
EP-1292594-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF TUMOURS AstraZeneca AB (SE) 2003-03-19 EP disclosed
WO-2001094341-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF TUMOURS ASTRAZENECA AB (SE) 2001-12-13 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 (4 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-20060258642-A1 Quinazoline derivatives for the treatment of tumours TPD52L2, NQO2, H1-5 SRC 1986/4885KDR 2002/4885CSK 963/4885
US-20040214841-A1 Quinazoline derivatives for treatment of tumours NQO2, TOP1, TPD52L2 SRC 1906/4885KDR 1659/4885CSK 580/4885
US-20050038050-A1 Quinazoline derivatives for the treatment of t cell mediated diseases CD4, HLA-DRB1, IFNG SRC 3241/4885KDR 4015/4885CSK 745/4885
US-20100280042-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF TUMOURS TPD52L2, NQO2, H1-5 SRC 1986/4885KDR 2002/4885CSK 963/4885

“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.