SCHEMBL10061668

SCHEMBL10061668

C=C1NCc2cc(N(C)C3CCN(C)CC3)ccc2N1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.40
FLT1 P17948 1/20 0.40
KDM4C Q9H3R0 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.33
EED O75530 1/20 0.33
POLB P06746 2/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
FPR2 P25090 1/20 0.32
PROKR1 Q8TCW9 1/20 0.32
NMT1 P30419 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HTR2A P28223 6/20 0.32
HTR2C P28335 6/20 0.32
AXL P30530 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL10061670 0.80 FGFR1 (0.40) FGFR1FLT1KDM4CPOLBMEN1
SCHEMBL10061679 0.74 CXCR4 (0.41) KDM4CPOLBTSHRMAPK1SMN1; SMN2
SCHEMBL10061688 0.70 GAA (0.44) MEN1HTTKMT2AMAPK1SMN1; SMN2
SCHEMBL12082340 0.67 HTR2A (0.55) FGFR1FLT1EEDPOLBFPR2
SCHEMBL10061672 0.66 PARP1 (0.42) TSHRALDH1A1NOS3NOS1NOS2
SCHEMBL13046490 0.66 NSD2 (0.47) FGFR1FLT1HTR2AHTR2CALDH1A1
SCHEMBL27564797 0.66 POLB (0.42) FGFR1FLT1KDM4CPOLBMEN1
SCHEMBL24596843 0.66 HTR2A (0.56) FGFR1FLT1IRAK4EEDPOLB
SCHEMBL1126485 0.66 ALDH1A1 (0.43) FGFR1FLT1IRAK4EEDPOLB
SCHEMBL2056120 0.66 HTR2A (0.56) POLBFPR2PROKR1HTR2AHTR2C

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 FGFR1 338/4885FLT1 822/4885KDM4C 2129/4885

“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.