SCHEMBL23911846

SCHEMBL23911846

O=C(O)/C=C/c1ccc(-c2cn3cccc3c(Nc3ccc(N4CCOCC4)cc3)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 5/20 0.49
▸ ESR1 P03372 1/20 0.46
▸ JAK2 O60674 5/20 0.45
▸ SYK P43405 4/20 0.45
▸ NTRK1 P04629 1/20 0.45
▸ ROS1 P08922 1/20 0.45
▸ CSNK2A2 P19784 1/20 0.45
▸ FLT3 P36888 1/20 0.45
▸ CSNK2B P67870 1/20 0.45
▸ CSNK2A1 P68400 1/20 0.45
▸ BTK Q06187 1/20 0.45
▸ PTK6 Q13882 1/20 0.45
▸ CSNK2A3 Q8NEV1 1/20 0.45
▸ MAPT P10636 4/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL24179231 0.86 AURKA (0.65) AURKAJAK2SYKNTRK1ROS1
SCHEMBL23911848 0.82 AURKA (0.40) AURKAJAK2SYKNTRK1ROS1
SCHEMBL23911847 0.80 AURKA (0.66) AURKAJAK2SYKNTRK1ROS1
SCHEMBL11823556 0.73 MAPT (0.71) ESR1MAPTMEN1ALDH1A1KMT2A
SCHEMBL11823548 0.73 MAPT (0.71) ESR1MAPTMEN1ALDH1A1KMT2A
SCHEMBL2482275 0.70 AURKA (0.79) AURKAJAK2SYKNTRK1ROS1
SCHEMBL23911850 0.70 AURKA (0.81) AURKAJAK2SYKNTRK1ROS1
SCHEMBL22579262 0.69 MAPT (0.64) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL18455119 0.68 SYK (0.58) JAK2SYKNTRK1ROS1CSNK2A2
SCHEMBL21471537 0.68 AURKA (0.73) AURKAJAK2SYKNTRK1ROS1

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-11142535-B2 Heterocyclic compound as Syk inhibitor and/or Syk-HDAC dual inhibitor HANGZHOU INNOGATE PHARMA CO., LTD. (CN) 2021-10-12 — — 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-11142535-B2 Heterocyclic compound as Syk inhibitor and/or Syk-HDAC dual inhibitor SYK, HDAC1, HDAC2 AURKA 585/4885ESR1 2811/4885JAK2 92/4885

“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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