SCHEMBL3948488

SCHEMBL3948488

Cc1ccc(O)c(N2CCCC2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.44
KDM4E B2RXH2 5/20 0.44
ALDH1A1 P00352 5/20 0.44
HSD17B10 Q99714 5/20 0.44
HPGD P15428 3/20 0.44
RECQL P46063 1/20 0.44
MAPK1 P28482 3/20 0.42
TSHR P16473 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
MAPT P10636 1/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
GFER P55789 1/20 0.42
NPSR1 Q6W5P4 2/20 0.42
LMNA P02545 2/20 0.42
USP2 O75604 1/20 0.42
SCN10A Q9Y5Y9 1/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL24042938 0.84 ALDH1A1 (0.48) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL26129893 0.82 KDM4E (0.37) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL27902210 0.77 OPRK1 (0.42) CYP1A2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL15831861 0.76 CNR2 (0.52) CYP1A2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL25510487 0.74 CYP1A2 (0.42) CYP1A2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL23779540 0.74 SCN10A (0.51) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL6646384 0.74 SCN10A (0.51) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL7459387 0.73 CNR2 (0.47) CYP1A2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL15831847 0.73 CYP1A2 (0.41) CYP1A2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL15831793 0.73 HRH4 (0.61) KDM4EALDH1A1HSD17B10HPGDRECQL

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-20090048269-A1 CHEMICAL COMPOUNDS-821 ASTRAZENECA AB (SE) 2009-02-19 US disclosed
WO-2009022171-A1 PYRIDINYIIOXY PYRIDINES AS ALK5 INHIBITORS ASTRAZENECA AB (SE) 2009-02-19 WO 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-20090048269-A1 CHEMICAL COMPOUNDS-821 TGFBR1, TGFBR2, SMAD3 CYP1A2 2320/4885KDM4E 894/4885ALDH1A1 163/4885

“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.