SCHEMBL9107932

SCHEMBL9107932

O=C(O)C(CC1CCCC1)N1C(=O)Cc2cc(Cl)ccc21

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.39
GRN P28799 1/20 0.39
SORT1 Q99523 1/20 0.39
CRHR1 P34998 1/20 0.38
P2RX3 P56373 1/20 0.37
NOTUM Q6P988 2/20 0.37
METAP2 P50579 2/20 0.37
METAP1 P53582 1/20 0.37
GCK P35557 2/20 0.36
NAMPT P43490 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
MC4R P32245 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
SCHEMBL9104376 0.91 GRN (0.39) CNR2GRNSORT1CRHR1NOTUM
SCHEMBL9106355 0.86 NAMPT (0.37) NAMPTALDH1A1PTGDR2
SCHEMBL9107495 0.86 PDE5A (0.45) GCKNAMPT
SCHEMBL9106741 0.84 OPRM1 (0.44) NOTUMALDH1A1
SCHEMBL9103314 0.83 NPC1 (0.40) NOTUMGCKNAMPTPTGDR2
SCHEMBL2003570 0.81 P2RX3 (0.42) P2RX3NOTUMALDH1A1PTGDR2
SCHEMBL9108882 0.80 GCK (0.51) GCK
SCHEMBL9102246 0.80 KDM4E (0.39) ALDH1A1
SCHEMBL9107017 0.80 GCK (0.53) GCK
SCHEMBL9104014 0.80 GCK (0.61) GCK

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 1 patent. 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 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 CNR2 598/4885GRN 2021/4885SORT1 4172/4885

“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.