SCHEMBL7797896

SCHEMBL7797896

Nc1c(Cl)ccc2nc(NCCO)nc(Cc3ccc4c(c3)OCO4)c12

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 10/20 0.51
LTB4R Q15722 1/20 0.43
SLC2A1 P11166 1/20 0.38
F2R P25116 1/20 0.37
CHRM4 P08173 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CLK1 P49759 1/20 0.37
CLK2 P49760 1/20 0.37
CLK3 P49761 1/20 0.37
DYRK1A Q13627 1/20 0.37
CLK4 Q9HAZ1 1/20 0.37
DYRK1B Q9Y463 1/20 0.37
BCDIN3D Q7Z5W3 1/20 0.36

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
SCHEMBL7797440 0.87 HSP90AB1 (0.40) HSP90AB1LTB4RSLC2A1CHRM4ALDH1A1
SCHEMBL7794741 0.83 CHRM4 (0.42) HSP90AB1LTB4RCHRM4ALDH1A1HSD17B10
SCHEMBL8862704 0.83 LTB4R (0.46) HSP90AB1LTB4RSLC2A1CHRM4ALDH1A1
SCHEMBL27379780 0.82 SLC2A1 (0.47) HSP90AB1LTB4RSLC2A1ALDH1A1HSD17B10
SCHEMBL8862871 0.80 HSP90AB1 (0.40) HSP90AB1LTB4RSLC2A1CHRM4ALDH1A1
SCHEMBL7794333 0.80 KMT2A (0.45) HSP90AB1LTB4RCHRM4ALDH1A1HSD17B10
SCHEMBL7796187 0.79 LTB4R (0.43) HSP90AB1LTB4RALDH1A1HSD17B10BCDIN3D
SCHEMBL8003792 0.79 HSP90AB1 (0.39) HSP90AB1LTB4RSLC2A1CHRM4ALDH1A1
SCHEMBL9094776 0.78 LTB4R (0.41) HSP90AB1LTB4RCHRM4ALDH1A1HSD17B10
SCHEMBL29801535 0.76 LTB4R (0.43) HSP90AB1LTB4RSLC2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010031760-A1 Method of treating a patient having precancerous lesions with quinazoline derivatives PAMUKCU RIFAT (US) 2001-10-18 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-20010031760-A1 Method of treating a patient having precancerous lesions with quinazoline derivatives MKI67, PCNA, NQO2 HSP90AB1 2725/4885LTB4R 1536/4885SLC2A1 2683/4885

“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.