SCHEMBL6467912

SCHEMBL6467912

CN1CCN([C@H]2CC[C@H](n3cc(-c4ccc(OCc5ccccc5)cc4)c4c(N)ncnc43)CC2)CC1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 7/20 0.80
HCK P08631 6/20 0.80
LCK P06239 6/20 0.80
TEK Q02763 6/20 0.80
INSR P06213 5/20 0.80
LYN P07948 4/20 0.80
KDR P35968 3/20 0.80
PAK4 O96013 2/20 0.80
CHEK2 O96017 2/20 0.80
CSF1R P07333 2/20 0.80
FGFR1 P11362 2/20 0.80
RPS6KB1 P23443 2/20 0.80
MARK3 P27448 2/20 0.80
FLT4 P35916 2/20 0.80
FLT3 P36888 2/20 0.80
CSNK1D P48730 2/20 0.80
BLK P51451 2/20 0.80
NEK2 P51955 2/20 0.80
LIMK1 P53667 2/20 0.80
PAK1 Q13153 2/20 0.80

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
SCHEMBL6461152 1.00 SRC (0.80) SRCHCKLCKTEKINSR
SCHEMBL6461155 1.00 SRC (0.80) SRCHCKLCKTEKINSR
SCHEMBL5936266 0.91 IGF1R (0.86) SRCHCKLCKTEKINSR
SCHEMBL5936251 0.91 IGF1R (0.86) SRCHCKLCKTEKINSR
SCHEMBL5936256 0.91 IGF1R (0.86) SRCHCKLCKTEKINSR
SCHEMBL16752462 0.89 SRC (1.00) SRCHCKLCKTEKINSR
SCHEMBL14106768 0.89 SRC (1.00) SRCHCKLCKTEKINSR
SCHEMBL14183078 0.89 SRC (1.00) SRCHCKLCKTEKINSR
SCHEMBL16752413 0.89 SRC (1.00) SRCHCKLCKTEKINSR
SCHEMBL30143839 0.89 SRC (1.00) SRCHCKLCKTEKINSR

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-20050008640-A1 Method of treating transplant rejection ABBOTT LABORATORIES 2005-01-13 US disclosed
US-6713474-B2 SERINE-THREONINE AND TYROSINE KINASE INHIBITORS ABBOTT GMBH & CO. KG (DE) 2004-03-30 US disclosed
US-20030153752-A1 Pyrrolopyrimidines as therapeutic agents ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2003-08-14 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-20050008640-A1 Method of treating transplant rejection LCK, ZAP70, FYN SRC 46/4885HCK 107/4885LCK 1/4885
US-20030153752-A1 Pyrrolopyrimidines as therapeutic agents FLT1, FLT4, TFPI SRC 206/4885HCK 968/4885LCK 6/4885

“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.