SCHEMBL12650207

SCHEMBL12650207

CCc1cccc(-c2cc(Nc3ccc(C(=O)N4CCOCC4)cn3)c(=O)n(C)n2)c1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BTK Q06187 16/20 0.55
SRC P12931 1/20 0.52
KDM4E B2RXH2 1/20 0.51
RAB9A P51151 1/20 0.51
CLK2 P49760 1/20 0.51
TYK2 P29597 1/20 0.49
BDKRB1 P46663 1/20 0.42

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
SCHEMBL12602967 0.92 BTK (0.54) BTKSRCKDM4ERAB9ACLK2
SCHEMBL16415939 0.91 BTK (0.55) BTKSRCKDM4ERAB9ACLK2
SCHEMBL105830 0.90 BTK (0.52) BTKSRCKDM4ERAB9ACLK2
SCHEMBL12602965 0.89 BTK (0.51) BTKSRCKDM4ERAB9ACLK2
SCHEMBL12602921 0.89 BTK (0.53) BTKSRCKDM4ERAB9ACLK2
SCHEMBL103714 0.89 BTK (0.51) BTKSRCKDM4ERAB9ACLK2
SCHEMBL12650243 0.88 BTK (0.51) BTKSRCKDM4ERAB9ACLK2
SCHEMBL12650209 0.88 BTK (0.52) BTKSRCKDM4ERAB9ACLK2
SCHEMBL104011 0.88 BTK (0.52) BTKSRCKDM4ERAB9ACLK2
SCHEMBL103815 0.87 BTK (0.58) BTKSRCKDM4ERAB9ACLK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7943618-B2 Btk protein kinase inhibitors ROCHE PALO ALTO LLC (US) 2011-05-17 US disclosed
US-20090105209-A1 BTK protein kinase inhibitors ROCHE PALO ALTO LLC 2009-04-23 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 (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-20090105209-A1 BTK protein kinase inhibitors BTK, SYK, LYN BTK 1/4885SRC 110/4885KDM4E 1225/4885

“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.