SCHEMBL9107559

SCHEMBL9107559

CC(C)CC(C(=O)Nc1ccccn1)N1C(=O)Cc2cc(Br)ccc21

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.41
LMNA P02545 3/20 0.41
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 2/20 0.41
GCK P35557 2/20 0.41
NPC1 O15118 2/20 0.40
POLB P06746 1/20 0.40
SORT1 Q99523 1/20 0.39
MMP1 P03956 3/20 0.39
MMP3 P08254 3/20 0.39
MMP9 P14780 3/20 0.39
MMP2 P08253 1/20 0.39
MMP7 P09237 1/20 0.39
SHMT2 P34897 1/20 0.38
USP2 O75604 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL9104313 0.90 RAB9A (0.42) RAB9ALMNAALDH1A1KDM4EGCK
SCHEMBL9105915 0.89 FFAR2 (0.45) RAB9ALMNAALDH1A1KDM4EGCK
SCHEMBL9104726 0.88 LMNA (0.45) RAB9ALMNAALDH1A1KDM4EGCK
SCHEMBL9908099 0.88 GAA (0.38) RAB9AKDM4EGCKNPC1POLB
SCHEMBL9103176 0.88 GAA (0.38) RAB9AKDM4EGCKNPC1POLB
SCHEMBL9103283 0.87 F2 (0.42) RAB9ALMNAALDH1A1KDM4EGCK
SCHEMBL9103451 0.84 GCK (0.51) ALDH1A1KDM4EGCKSORT1
SCHEMBL9107671 0.84 RAB9A (0.38) RAB9ALMNAALDH1A1KDM4EGCK
SCHEMBL9103205 0.83 FFAR2 (0.45) RAB9ALMNAALDH1A1KDM4EGCK
SCHEMBL9908098 0.83 GCK (0.40) RAB9ALMNAALDH1A1KDM4EGCK

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 RAB9A 1778/4885LMNA 4226/4885ALDH1A1 646/4885

“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.