SCHEMBL3303404

SCHEMBL3303404

COc1ccc(-c2[nH]nnc2-c2cc(OC)c(OC)c(OC)c2)cc1NC(=O)C(N)CC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CIT O14578 1/20 0.38
ALDH1A1 P00352 1/20 0.36
CASR P41180 1/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
POLB P06746 1/20 0.35
FYN P06241 1/20 0.35
AAK1 Q2M2I8 2/20 0.34
LTB4R Q15722 1/20 0.34
GRK6 P43250 1/20 0.34
PKM P14618 1/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TP53 P04637 1/20 0.34

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
Hydrochloric Acid SCHEMBL412362 0.99 CIT (0.38) CITALDH1A1CASRLMNAMAPT
SCHEMBL3299214 0.94 CIT (0.39) CITALDH1A1CASRLMNAMAPT
Hydrochloric Acid SCHEMBL408290 0.93 CIT (0.38) CITALDH1A1CASRLMNAMAPT
SCHEMBL3304907 0.91 CIT (0.35) CITCASRLMNAMAPTMEN1
SCHEMBL3306917 0.91 CIT (0.47) CITAAK1
SCHEMBL10189798 0.91 FYN (0.37) CITALDH1A1CASRLMNAMAPT
SCHEMBL3303340 0.91 MAPT (0.39) CITALDH1A1CASRLMNAMAPT
Hydrochloric Acid SCHEMBL412343 0.90 ADAMTS4 (0.35) CITCASRLMNAMAPTMEN1
Hydrochloric Acid SCHEMBL410981 0.90 CIT (0.47) CITAAK1
Hydrochloric Acid SCHEMBL412941 0.90 MAPT (0.38) CITALDH1A1CASRLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9175022-B2 Compounds for the treatment of proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2015-11-03 US disclosed
US-20100279410-A1 COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. 2010-11-04 US disclosed
US-20100279410-A1 COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. 2010-11-04 US disclosed
US-7781462-B2 Compounds for the treatment of proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2010-08-24 US disclosed
US-7781462-B2 Compounds for the treatment of proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2010-08-24 US disclosed
US-20100093670-A1 Compounds for the treatment of angiogenesis SYNTA PHARMACEUTICALS CORP. 2010-04-15 US disclosed
US-20070238699-A1 Compounds for the treatment of proliferative disorders SYNTA PHARMACEUTICALS CORP. 2007-10-11 US disclosed
US-20070238699-A1 Compounds for the treatment of proliferative disorders SYNTA PHARMACEUTICALS CORP. 2007-10-11 US disclosed
WO-2007014198-A1 1, 2, 3 -TRIAZOLES INHIBITORS OF TUBULIN POLYMERIZATION FOR THE TREATMENT OF POLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. (US) 2007-02-01 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 (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-20070238699-A1 Compounds for the treatment of proliferative disorders RB1, MKI67, MAPRE1 CIT 337/4885ALDH1A1 1872/4885CASR 3021/4885
US-20100093670-A1 Compounds for the treatment of angiogenesis FLT4, FLT1, TEK CIT 787/4885ALDH1A1 414/4885CASR 3937/4885

“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.