SCHEMBL22331125

SCHEMBL22331125

COc1ccc(-c2c(C(=O)Nc3ccccc3)oc3cc(O)c(Cl)cc3c2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 3/20 0.48
HSP90AB1 P08238 3/20 0.48
PDK1 Q15118 2/20 0.48
MAOB P27338 2/20 0.47
KMT2A Q03164 3/20 0.46
MAPT P10636 6/20 0.45
TP53 P04637 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
KDM4E B2RXH2 2/20 0.44
TSHR P16473 4/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
RXFP1 Q9HBX9 1/20 0.43
ALDH1A1 P00352 3/20 0.43
HSD17B10 Q99714 2/20 0.43
MEN1 O00255 2/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP3A4 P08684 1/20 0.43

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
SCHEMBL4394078 0.86 CA1 (0.48) HSP90AA1KMT2AMAPTTP53SMN1; SMN2
SCHEMBL4396935 0.85 CELA1 (0.51) HSP90AA1HSP90AB1PDK1KMT2AMAPT
SCHEMBL2948885 0.78 ALDH1A1 (0.57) MAOBKMT2AMAPTTP53SMN1; SMN2
SCHEMBL3089612 0.72 ALDH1A1 (0.54) HSP90AA1KMT2AMAPTTP53SMN1; SMN2
SCHEMBL3096814 0.72 ALDH1A1 (0.58) HSP90AA1KMT2AMAPTTP53SMN1; SMN2
SCHEMBL5270355 0.71 KDM4E (0.65) KMT2AMAPTTP53SMN1; SMN2KDM4E
SCHEMBL16698022 0.70 KDM4E (0.67) MAOBKMT2AMAPTTP53SMN1; SMN2
SCHEMBL2944800 0.70 ALDH1A1 (0.68) MAOBKMT2AMAPTTP53SMN1; SMN2
SCHEMBL22331074 0.69 HSP90AA1 (0.77) HSP90AA1HSP90AB1PDK1
SCHEMBL11550681 0.69 ALDH1A1 (0.70) KMT2AMAPTTP53SMN1; SMN2KDM4E

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-10744213-B2 Fluorescent compounds for imaging of blood vessels and blood flow, and an in vivo screen for pro- and anti-angiogenic agents COLOSSUS BIOPHARMA CONSULTANTS COMPANY, LIMITED (TW) 2020-08-18 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-10744213-B2 Fluorescent compounds for imaging of blood vessels and blood flow, and an in vivo screen for pro- and anti-angiogenic agents FLT4, VEGFA, FLT1 HSP90AA1 2235/4885HSP90AB1 2342/4885PDK1 4066/4885

“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.