SCHEMBL21155014

SCHEMBL21155014

O=C(ONCCCNCO)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
KMT2A Q03164 4/20 0.46
MAPT P10636 2/20 0.46
POLB P06746 1/20 0.46
TDP1 Q9NUW8 4/20 0.43
TSHR P16473 3/20 0.43
LMNA P02545 3/20 0.41
F2 P00734 1/20 0.41
TP53 P04637 1/20 0.40
PKM P14618 1/20 0.39
CASP3 P42574 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
MAPK1 P28482 2/20 0.39
SLC6A3 Q01959 2/20 0.39
HIF1A Q16665 1/20 0.39
SLC6A2 P23975 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.38
HPGD P15428 3/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL8375337 0.85 KMT2A (0.50) ALDH1A1KMT2AMAPTPOLBTDP1
SCHEMBL10904247 0.84 KMT2A (0.53) ALDH1A1KMT2AMAPTPOLBTDP1
SCHEMBL20093506 0.84 HTT (0.46) ALDH1A1KMT2AMAPTPOLBTDP1
Hydrochloric Acid SCHEMBL10905007 0.83 KMT2A (0.52) ALDH1A1KMT2AMAPTPOLBTDP1
Hydrochloric Acid SCHEMBL10904248 0.83 KMT2A (0.52) ALDH1A1KMT2AMAPTPOLBTDP1
SCHEMBL26460865 0.83 TDP1 (0.46) ALDH1A1KMT2AMAPTPOLBTDP1
SCHEMBL27954014 0.81 ALDH1A1 (0.53) ALDH1A1KMT2AMAPTPOLBTDP1
SCHEMBL10061827 0.81 KMT2A (0.57) ALDH1A1KMT2AMAPTPOLBTDP1
SCHEMBL3492807 0.80 LMNA (0.51) ALDH1A1KMT2AMAPTPOLBTDP1
SCHEMBL14974133 0.79 POLB (0.47) ALDH1A1KMT2AMAPTPOLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10751419-B2 Method for synthesis of reactive conjugate clusters IONIS PHARMACEUTICALS, INC. (US) 2020-08-25 US disclosed
US-20190209694-A1 METHOD FOR SYNTHESIS OF REACTIVE CONJUGATE CLUSTERS IONIS PHARMACEUTICALS, INC. (US) 2019-07-11 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 (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-10751419-B2 Method for synthesis of reactive conjugate clusters ACOT7, COASY, LCAT ALDH1A1 1477/4885KMT2A 849/4885MAPT 1280/4885
US-20190209694-A1 METHOD FOR SYNTHESIS OF REACTIVE CONJUGATE CLUSTERS ACOT7, COASY, LCAT ALDH1A1 1477/4885KMT2A 849/4885MAPT 1280/4885

“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.