SCHEMBL3942011

SCHEMBL3942011

Clc1nccc(Nc2cc(CCc3ccco3)n[nH]2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 5/20 0.40
FGFR1 P11362 2/20 0.40
KDR P35968 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.34
SYK P43405 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
KMT2A Q03164 4/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
RECQL P46063 1/20 0.32
ITK Q08881 1/20 0.32
MEN1 O00255 1/20 0.32
PKM P14618 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HTR3E A5X5Y0 1/20 0.32
HTR3B O95264 1/20 0.32
HTR3A P46098 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
SCHEMBL3928183 0.82 IGF1R (0.41) IGF1RFGFR1KDRSYKCYP1A2
SCHEMBL5103415 0.78 IGF1R (0.62) IGF1RFGFR1KDR
SCHEMBL5096819 0.77 IGF1R (0.49) IGF1RFGFR1KDR
SCHEMBL4158014 0.77 IGF1R (0.39) IGF1RFGFR1KDR
SCHEMBL3976688 0.76 NOS2 (0.42) IGF1RFGFR1KDRROCK1
SCHEMBL4147235 0.75 IGF1R (0.36) IGF1RFGFR1KDR
SCHEMBL4015205 0.75 IGF1R (0.63) IGF1RFGFR1KDR
SCHEMBL3928820 0.75 CLK4 (0.42) IGF1RFGFR1KDRSMN1; SMN2CYP1A2
SCHEMBL3980913 0.75 FGFR1 (0.50) IGF1RFGFR1KDR
SCHEMBL3934716 0.75 NR3C2 (0.44) IGF1RFGFR1KDRSMN1; SMN2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2044063-A1 PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER Astra Zeneca AB (SE) 2009-04-08 EP disclosed
WO-2008001070-A1 PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2008-01-03 WO disclosed
US-20080004302-A1 Novel Compounds ASTRAZENECA AB (SE) 2008-01-03 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-20080004302-A1 Novel Compounds CYP11B2, CYP11B1, CYP46A1 IGF1R 3217/4885FGFR1 1428/4885KDR 3815/4885

“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.