SCHEMBL9107280

SCHEMBL9107280

COC(=O)C(CC(C)C)N1C(=O)C(=O)c2c(Cl)cccc21

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
NOS2 P35228 1/20 0.39
ALDH1A1 P00352 2/20 0.39
TGM2 P21980 2/20 0.38
ELANE P08246 4/20 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
SCHEMBL9107630 0.86 BCL2 (0.44) KMT2ATGM2
SCHEMBL9107293 0.82 CCKBR (0.39) MEN1KMT2ATGM2ELANE
SCHEMBL9107681 0.81 MAPT (0.49) SMN1; SMN2MEN1CYP1A2CYP3A4CYP2D6
SCHEMBL9104273 0.78 NPSR1 (0.43) SMN1; SMN2MEN1CYP1A2CYP3A4CYP2D6
SCHEMBL9105927 0.77 GCK (0.45) MEN1KMT2AALDH1A1
SCHEMBL9108726 0.77 NPSR1 (0.42) SMN1; SMN2MEN1CYP1A2CYP3A4CYP2D6
SCHEMBL281692 0.77 KMT2A (0.40) MEN1KMT2AMAPTALDH1A1TGM2
SCHEMBL9908080 0.77 GCK (0.41) SMN1; SMN2MAPTALDH1A1
SCHEMBL9101953 0.76 GCK (0.66) MEN1KMT2AALDH1A1
SCHEMBL9106900 0.76 KDM4E (0.44) MEN1KMT2AMAPTTGM2

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 SMN1; SMN2 1483/4885MEN1 2086/4885CYP1A2 60/4885

“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.