SCHEMBL18294604

SCHEMBL18294604

O=c1cc(-c2cccc(Cl)c2)[nH]c2ccc3c(c12)OCO3

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.50
MEN1 O00255 2/20 0.45
ALDH1A1 P00352 2/20 0.45
KMT2A Q03164 2/20 0.45
THRB P10828 1/20 0.45
CSNK1D P48730 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
SCHEMBL15233696 0.86 PDE10A (0.55) PDE10AMEN1ALDH1A1KMT2A
SCHEMBL339313 0.86 HPGD (0.54) PDE10AMEN1ALDH1A1KMT2ATHRB
SCHEMBL18294612 0.86 PDE10A (0.50) PDE10AALDH1A1CSNK1D
SCHEMBL8980373 0.79
SCHEMBL340523 0.79 PDE10A (0.50) PDE10AMEN1ALDH1A1KMT2A
SCHEMBL339249 0.75 NPC1 (0.65) PDE10A
SCHEMBL6295907 0.71 ALDH1A1 (0.81) PDE10AMEN1ALDH1A1KMT2ATHRB
SCHEMBL8980201 0.67 PDE10A (0.72) PDE10AMEN1ALDH1A1KMT2ATHRB
SCHEMBL6300496 0.67 ALDH1A1 (0.82) MEN1ALDH1A1KMT2ATHRB
SCHEMBL10915643 0.65 NQO2 (0.41) PDE10AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9717721-B2 Use of aryl-quinolin derivatives as inhibitors of vasculogenic mimicry TAIRX, INC. (TW) 2017-08-01 US disclosed
US-9717721-B2 Use of aryl-quinolin derivatives as inhibitors of vasculogenic mimicry TAIRX, INC. (TW) 2017-08-01 US disclosed
US-20160354361-A1 NOVEL USE OF ARYL-QUINOLIN DERIVATIVES AS INHIBITORS OF VASCULOGENIC MIMICRY TAIRX INC. (TW) 2016-12-08 US disclosed
US-20160354361-A1 NOVEL USE OF ARYL-QUINOLIN DERIVATIVES AS INHIBITORS OF VASCULOGENIC MIMICRY TAIRX INC. (TW) 2016-12-08 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-20160354361-A1 NOVEL USE OF ARYL-QUINOLIN DERIVATIVES AS INHIBITORS OF VASCULOGENIC MIMICRY TEK, FLT1, VHL PDE10A 2742/4885MEN1 754/4885ALDH1A1 1091/4885

“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.