SCHEMBL17065602

SCHEMBL17065602

CN(C)C/C=C/C(=O)N1CC2CC(n3cc(-c4ccc(C(=O)Nc5ccccc5)cc4)c4c(N)ncnc43)CC2C1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BTK Q06187 14/20 0.53
EGFR P00533 12/20 0.53
FGFR1 P11362 2/20 0.47
FGFR4 P22455 2/20 0.47
FGFR2 P21802 2/20 0.47
FGFR3 P22607 1/20 0.47
LCK P06239 1/20 0.47
ITK Q08881 1/20 0.47
ABL1 P00519 1/20 0.46
ABL2 P42684 1/20 0.46
SRC P12931 1/20 0.45

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
SCHEMBL17065606 1.00 BTK (0.53) BTKEGFRFGFR1FGFR4FGFR2
SCHEMBL18335280 0.94 BTK (0.48) BTKEGFRABL1ABL2SRC
SCHEMBL17065587 0.94 BTK (0.48) BTKEGFRABL1ABL2SRC
SCHEMBL17065590 0.91 BTK (0.48) BTKEGFRITKABL1ABL2
SCHEMBL17065604 0.87 BTK (0.59) BTKEGFRFGFR1FGFR4FGFR2
SCHEMBL17065652 0.86 EGFR (0.64) BTKEGFRFGFR2LCKITK
SCHEMBL17065649 0.86 EGFR (0.64) BTKEGFRFGFR2LCKITK
SCHEMBL17065644 0.82 ABL1 (0.51) BTKEGFRLCKABL1ABL2
SCHEMBL18335298 0.80 BTK (0.61) BTKEGFRLCKITK
SCHEMBL17065669 0.80 BTK (0.61) BTKEGFRLCKITK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160376277-A1 NOVEL HETEROCYCLIC COMPOUNDS CADILA HEALTHCARE LIMITED (IN) 2016-12-29 US claimed
EP-3102579-A2 HETEROCYCLIC COMPOUNDS Cadila Healthcare Limited (IN) 2016-12-14 EP claimed
WO-2015132799-A2 NOVEL HETEROCYCLIC COMPOUNDS CADILA HEALTHCARE LIMITED (IN) 2015-09-11 WO claimed
EP-3102579-B1 HETEROCYCLIC COMPOUNDS CADILA HEALTHCARE LTD (IN) 2019-04-10 EP disclosed
US-9840509-B2 Heterocyclic compounds CADILA HEALTHCARE LIMITED (IN) 2017-12-12 US disclosed
US-9840509-B2 Heterocyclic compounds CADILA HEALTHCARE LIMITED (IN) 2017-12-12 US disclosed
US-9840509-B2 Heterocyclic compounds CADILA HEALTHCARE LIMITED (IN) 2017-12-12 US disclosed
US-20160376277-A1 NOVEL HETEROCYCLIC COMPOUNDS CADILA HEALTHCARE LIMITED (IN) 2016-12-29 US disclosed
US-20160376277-A1 NOVEL HETEROCYCLIC COMPOUNDS CADILA HEALTHCARE LIMITED (IN) 2016-12-29 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-20160376277-A1 NOVEL HETEROCYCLIC COMPOUNDS BTK, LYN, SYK BTK 1/4885EGFR 425/4885FGFR1 419/4885

“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.