SCHEMBL17065745

SCHEMBL17065745

C=CC(=O)N1CCC2CC(n3cc(-c4ccc(C(=O)Nc5ccccc5)cc4)c4c(N)ncnc43)CC21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 6/20 0.51
EGFR P00533 8/20 0.50
ABL1 P00519 4/20 0.50
ABL2 P42684 4/20 0.50
SRC P12931 6/20 0.48
FGFR2 P21802 3/20 0.48
LCK P06239 3/20 0.47
KDR P35968 3/20 0.47
TEK Q02763 3/20 0.47
RIPK2 O43353 1/20 0.46
PRKD3 O94806 1/20 0.46
PRKCG P05129 1/20 0.46
PRKCB P05771 1/20 0.46
PRKCA P17252 1/20 0.46
PRKCH P24723 1/20 0.46
PRKCI P41743 1/20 0.46
PRKCE Q02156 1/20 0.46
PRKCQ Q04759 1/20 0.46
PRKCZ Q05513 1/20 0.46
PRKCD Q05655 1/20 0.46

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
SCHEMBL17065604 0.89 BTK (0.59) BTKEGFRABL1ABL2SRC
SCHEMBL17065738 0.85 BTK (0.66) BTKEGFRABL1ABL2SRC
SCHEMBL17065644 0.84 ABL1 (0.51) BTKEGFRABL1ABL2SRC
SCHEMBL18335324 0.83 BTK (0.52) BTKEGFRABL1ABL2SRC
SCHEMBL17065588 0.79 BTK (0.74) BTKEGFRABL1ABL2SRC
SCHEMBL17065742 0.79 EGFR (0.51) BTKEGFRABL1ABL2FGFR2
SCHEMBL19973400 0.79 SRC (0.70) BTKEGFRABL1ABL2SRC
SCHEMBL17065602 0.78 BTK (0.53) BTKEGFRABL1ABL2SRC
SCHEMBL17065600 0.78 BTK (0.63) BTKEGFRABL1ABL2SRC
SCHEMBL17065606 0.78 BTK (0.53) BTKEGFRABL1ABL2SRC

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 425/4885ABL1 5/4885

“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.