SCHEMBL1630689

SCHEMBL1630689

O=CN(Cc1cccnc1)c1cc(C(=O)NCc2cccnc2)c(-c2ccccc2)nc1NCCc1cccc(F)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.48
KMT2A Q03164 3/20 0.43
HTT P42858 1/20 0.43
ALDH1A1 P00352 6/20 0.43
LMNA P02545 2/20 0.43
MAPK1 P28482 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
USP2 O75604 1/20 0.41
PKM P14618 1/20 0.41
CSNK2A2 P19784 1/20 0.41
CSNK2A1 P68400 1/20 0.41
KDM4E B2RXH2 2/20 0.40
NAMPT P43490 1/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
RAB9A P51151 1/20 0.39
F2 P00734 1/20 0.39

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
SCHEMBL1631250 0.88 GBA1 (0.51) GBA1KMT2ALMNAOPRM1OPRD1
SCHEMBL12724310 0.87 GBA1 (0.55) GBA1KMT2AHTTALDH1A1LMNA
SCHEMBL1632677 0.87 GBA1 (0.41) GBA1KMT2AHTTALDH1A1LMNA
SCHEMBL1630722 0.84 GBA1 (0.49) GBA1KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL12724309 0.82 GBA1 (0.53) GBA1KMT2AHTTALDH1A1LMNA
SCHEMBL1631784 0.81 GBA1 (0.52) GBA1KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL12724312 0.80 GBA1 (0.51) GBA1KMT2AHTTALDH1A1LMNA
SCHEMBL1632853 0.80 GBA1 (0.44) GBA1KMT2ALMNAOPRM1OPRD1
SCHEMBL1882650 0.79 PKM (0.43) GBA1KMT2ALMNAOPRM1OPRD1
SCHEMBL1630692 0.79 GBA1 (0.47) GBA1KMT2AHTTALDH1A1LMNA

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 4031/4885KMT2A 2544/4885HTT 1911/4885

“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.