SCHEMBL22441534

SCHEMBL22441534

COc1cc2nccc(N3CCN(CCNC(=O)O)C(C)C3)c2cc1OC

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 10/20 0.52
EHMT1 Q9H9B1 10/20 0.52
PDGFRB P09619 4/20 0.48
NCF1 P14598 1/20 0.47
PDGFRA P16234 3/20 0.43
FLT3 P36888 1/20 0.42
KIT P10721 4/20 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
SCHEMBL22445496 1.00 EHMT2 (0.52) EHMT2EHMT1PDGFRBNCF1PDGFRA
SCHEMBL22455218 0.89 DRD2 (0.48) EHMT2EHMT1PDGFRBNCF1FLT3
SCHEMBL29357549 0.89 DRD2 (0.48) EHMT2EHMT1PDGFRBNCF1FLT3
SCHEMBL28681217 0.89 DRD2 (0.48) EHMT2EHMT1PDGFRBNCF1FLT3
SCHEMBL28685913 0.87 EHMT2 (0.47) EHMT2EHMT1PDGFRBNCF1PDGFRA
SCHEMBL22455368 0.85 ENPP1 (0.49) EHMT2EHMT1PDGFRBNCF1
SCHEMBL35210187 0.84 NCF1 (0.47) EHMT2EHMT1PDGFRBNCF1PDGFRA
SCHEMBL22445544 0.83 NCF1 (0.54) EHMT2EHMT1PDGFRBNCF1FLT3
SCHEMBL22441506 0.83 NCF1 (0.54) EHMT2EHMT1PDGFRBNCF1FLT3
SCHEMBL22441504 0.83 NCF1 (0.54) EHMT2EHMT1PDGFRBNCF1FLT3

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-11407729-B2 Quinoline and quinazoline compounds and methods of use thereof Stingray Therapeutics, Inc. (US) 2022-08-09 US disclosed
US-20200299258-A1 QUINOLINE AND QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF STINGRAY THERAPEUTICS INC (US) 2020-09-24 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 (2 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-20200299258-A1 QUINOLINE AND QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF ENPP1, ENPP3, PDE7A EHMT2 2342/4885EHMT1 1468/4885PDGFRB 3543/4885
US-11407729-B2 Quinoline and quinazoline compounds and methods of use thereof ENPP1, ENPP3, PDE7A EHMT2 2342/4885EHMT1 1468/4885PDGFRB 3543/4885

“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.