SCHEMBL10061741

SCHEMBL10061741

C=C1NCCc2cc(NC3CCN(C)CC3)ccc2N1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.48
AXL P30530 2/20 0.43
ITK Q08881 1/20 0.39
HTR6 P50406 1/20 0.38
BRD4 O60885 1/20 0.36
ATAD2 Q6PL18 1/20 0.36
FLT3 P36888 7/20 0.35
LCK P06239 2/20 0.35
PDGFRA P16234 2/20 0.35
KDR P35968 2/20 0.35
ALK Q9UM73 2/20 0.35
RET P07949 1/20 0.35
NTRK1 P04629 3/20 0.35
NTRK3 Q16288 3/20 0.35
NTRK2 Q16620 3/20 0.35
TLR8 Q9NR97 2/20 0.34
TLR7 Q9NYK1 2/20 0.34
KCNH2 Q12809 1/20 0.34
TYRO3 Q06418 1/20 0.34
MERTK Q12866 1/20 0.34

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
SCHEMBL6898991 0.80 POLB (0.53) POLBAXLITKHTR6BRD4
SCHEMBL31335896 0.76 POLB (0.50) POLBAXLTYRO3MERTKDDB1
SCHEMBL13586867 0.74 POLB (0.52) POLBAXL
SCHEMBL10061747 0.73 GAA (0.42) HTR6KCNH2
SCHEMBL10061669 0.71 LRRK2 (0.36) AXLCSF1R
SCHEMBL1653697 0.70 POLB (0.50) POLBAXLITKHTR6BRD4
Hydrochloric Acid SCHEMBL31335858 0.69 DDB1 (0.44) POLBAXLTYRO3MERTKDDB1
SCHEMBL10269075 0.69 POLB (0.55) POLBAXLITKHTR6BRD4
SCHEMBL12853748 0.68 POLB (0.58) POLBAXLITKHTR6
SCHEMBL15041206 0.67 POLB (0.71) POLBAXLITKHTR6

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-8207179-B2 Substituted indolines as tyrosine kinase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-26 US disclosed
US-20100222331-A1 NEW COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-02 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-20100222331-A1 NEW COMPOUNDS CCNA1, CCNY, MKI67 POLB 2013/4885AXL 4413/4885ITK 4415/4885

“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.