SCHEMBL1631069

SCHEMBL1631069

NC(=O)C(c1cccnc1)c1ccc(-c2ccc(Cl)c(Cl)c2)nc1NCCc1ccccn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.40
MAPT P10636 3/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 2/20 0.38
JAK3 P52333 1/20 0.36
F2 P00734 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
HTT P42858 2/20 0.35
RAB9A P51151 2/20 0.35
ALDH1A1 P00352 1/20 0.35
PKM P14618 1/20 0.35
ABL1 P00519 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
GLA P06280 1/20 0.35
S1PR1 P21453 1/20 0.34
S1PR3 Q99500 1/20 0.34
EIF4E P06730 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 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
SCHEMBL1631717 0.91 KDM4E (0.42) GBA1LMNAJAK3F2SMN1; SMN2
SCHEMBL1630133 0.90 GBA1 (0.41) GBA1LMNAJAK3F2PKM
SCHEMBL1630995 0.89 GBA1 (0.48) GBA1MAPTKMT2ALMNAJAK3
SCHEMBL1631871 0.89 GBA1 (0.40) GBA1KMT2AJAK3RAB9AKDM4E
SCHEMBL1630280 0.89 GBA1 (0.40) GBA1MAPTKMT2ALMNAJAK3
SCHEMBL1632189 0.88 GBA1 (0.42) GBA1MAPTKMT2ALMNAJAK3
SCHEMBL1632119 0.88 PIK3CA (0.42) GBA1KMT2AJAK3RAB9AMEN1
SCHEMBL1631004 0.88 GBA1 (0.43) GBA1JAK3SMN1; SMN2HTTHIF1A
SCHEMBL1631445 0.88 GBA1 (0.41) GBA1MAPTKMT2AJAK3F2
SCHEMBL1631782 0.88 SMN1; SMN2 (0.43) GBA1KMT2ALMNAJAK3F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090012126-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2009-01-08 US claimed
US-7932270-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2011-04-26 US disclosed
US-20090012126-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2009-01-08 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-20090012126-A1 Certain chemical entities, compositions, and methods MYLK, MYH2, MYH10 GBA1 4031/4885MAPT 540/4885KMT2A 2544/4885

“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.