SCHEMBL1630133

SCHEMBL1630133

NC(=O)C(c1cccnc1)c1ccc(-c2cccc(Cl)c2)nc1NCCc1ccccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.41
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
KCNA5 P22460 3/20 0.40
F2 P00734 3/20 0.39
SYK P43405 1/20 0.39
CNR2 P34972 1/20 0.38
ACP1 P24666 1/20 0.37
LMNA P02545 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.36
JAK3 P52333 1/20 0.36
HIF1A Q16665 1/20 0.35
PKM P14618 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
ABL1 P00519 1/20 0.35
BCR P11274 1/20 0.35
PRKCA P17252 1/20 0.35
PRKCD Q05655 1/20 0.35

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
SCHEMBL1632119 0.91 PIK3CA (0.42) GBA1ADORA2AADORA1JAK3HIF1A
SCHEMBL1631717 0.91 KDM4E (0.42) GBA1F2SYKLMNAJAK3
SCHEMBL1630995 0.91 GBA1 (0.48) GBA1ADORA2AADORA1LMNAJAK3
SCHEMBL1632360 0.90 GBA1 (0.41) GBA1ADORA2AADORA1F2SYK
SCHEMBL1631069 0.90 GBA1 (0.40) GBA1F2LMNAJAK3HIF1A
SCHEMBL1632857 0.90 GBA1 (0.41) GBA1ADORA2AADORA1KCNA5SYK
SCHEMBL1631871 0.89 GBA1 (0.40) GBA1ADORA2AADORA1JAK3HIF1A
SCHEMBL1632558 0.88 KCNA5 (0.42) GBA1KCNA5SYKLMNAKDM4E
SCHEMBL1632258 0.88 ADORA2A (0.43) GBA1ADORA2AADORA1KCNA5LMNA
SCHEMBL1631111 0.88 ADORA2A (0.43) GBA1ADORA2AADORA1KCNA5SYK

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 4031/4885ADORA2A 2369/4885ADORA1 2532/4885

“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.