SCHEMBL24853341

SCHEMBL24853341

CC(C)(O)c1cccc2[nH]nc(N)c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 3/20 0.53
▸ GAA P10253 2/20 0.53
▸ MAP2K1 Q02750 2/20 0.49
▸ KDR P35968 9/20 0.47
▸ KIT P10721 7/20 0.47
▸ FLT3 P36888 7/20 0.47
▸ ROCK1 Q13464 5/20 0.45
▸ ABL1 P00519 5/20 0.45
▸ LCK P06239 4/20 0.45
▸ CSF1R P07333 4/20 0.45
▸ FGFR1 P11362 4/20 0.45
▸ PRKACA P17612 4/20 0.45
▸ CDK5 Q00535 4/20 0.45
▸ CLK4 Q9HAZ1 3/20 0.45
▸ PLK4 O00444 3/20 0.45
▸ AURKA O14965 3/20 0.45
▸ RPS6KB1 P23443 3/20 0.45
▸ MARK3 P27448 3/20 0.45
▸ MARK2 Q7KZI7 3/20 0.45
▸ AURKB Q96GD4 3/20 0.45

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
SCHEMBL30788040 1.00 PDPK1 (0.53) PDPK1GAAMAP2K1KDRKIT
SCHEMBL13236555 0.86 PDPK1 (0.56) PDPK1GAAMAP2K1KDRKIT
SCHEMBL30168107 0.84 KDR (0.48) PDPK1GAAMAP2K1KDRKIT
SCHEMBL24852599 0.84 KDR (0.48) PDPK1GAAMAP2K1KDRKIT
SCHEMBL2660889 0.79 GAA (0.56) PDPK1GAAMAP2K1KDRKIT
SCHEMBL10368038 0.73 PDPK1 (0.61) PDPK1GAAMAP2K1KDRKIT
SCHEMBL569660 0.73 GAA (0.61) PDPK1GAAMAP2K1KDRKIT
SCHEMBL20571471 0.72 GAA (0.56) PDPK1GAAMAP2K1KDRKIT
SCHEMBL628649 0.72 PDPK1 (0.66) PDPK1GAAMAP2K1KDRKIT
SCHEMBL30065304 0.72 PDPK1 (0.66) PDPK1GAAMAP2K1KDRKIT

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
US-20240383870-A1 HETEROCYCLIC ALDEHYDE TRAPPING COMPOUNDS AND USES THEREOF ALDEYRA THERAPEUTICS, INC. 2024-11-21 — — US disclosed
CN-117580569-A Heterocyclic aldehyde capture compounds and uses thereof 奥尔德拉医疗公司 2024-02-20 — — CN disclosed
WO-2023278816-A1 HETEROCYCLIC ALDEHYDE TRAPPING COMPOUNDS AND USES THEREOF ALDEYRA THERAPEUTICS, INC. (US) 2023-01-05 — — 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-20240383870-A1 HETEROCYCLIC ALDEHYDE TRAPPING COMPOUNDS AND USES THEREOF ALDH1A2, ALDH2, SSB PDPK1 3263/4885GAA 506/4885MAP2K1 4556/4885

“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.

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