SCHEMBL9106250

SCHEMBL9106250

O=C(Nc1ccccn1)C(CC1CCCC1)N1C(=O)Cc2ccc(Cl)cc21

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GCK P35557 11/20 0.51
S1PR1 P21453 1/20 0.43
S1PR3 Q99500 1/20 0.43
NPC1 O15118 1/20 0.40
MITF O75030 1/20 0.40
TP53 P04637 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
XBP1 P17861 1/20 0.40
RAB9A P51151 1/20 0.40
KDM4E B2RXH2 1/20 0.39
FFAR2 O15552 1/20 0.39
GRIK1 P39086 1/20 0.38
KCNMA1 Q12791 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
SCHEMBL9108882 0.93 GCK (0.51) GCKS1PR1S1PR3NPC1MITF
SCHEMBL9103429 0.89 GCK (0.51) GCKKDM4E
SCHEMBL9104469 0.89 GCK (0.53) GCKKDM4E
SCHEMBL9105910 0.89 GCK (0.51) GCKNPC1KDM4E
SCHEMBL9106417 0.89 GCK (0.53) GCKKDM4E
SCHEMBL9101774 0.89 GCK (0.52) GCKRAB9AKDM4EFFAR2
SCHEMBL9908120 0.89 GCK (0.52) GCKRAB9AKDM4EFFAR2
SCHEMBL9105164 0.87 GCK (0.49) GCKKDM4E
SCHEMBL9103205 0.84 FFAR2 (0.45) GCKS1PR1S1PR3NPC1MITF
SCHEMBL9107581 0.84 GCK (0.55) GCKS1PR1S1PR3KCNMA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS KESTER ROBERT FRANCIS (US) 2012-06-07 US claimed
US-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS KESTER ROBERT FRANCIS (US) 2012-06-07 US disclosed
US-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS KESTER ROBERT FRANCIS (US) 2012-06-07 US disclosed
US-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS KESTER ROBERT FRANCIS (US) 2012-06-07 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-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS GPR119, INSR, OAT GCK 488/4885S1PR1 3902/4885S1PR3 3734/4885

“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.