SCHEMBL14309148

SCHEMBL14309148

CC(C)N(C)C(=O)c1ccc2c(c1)OCO2

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.58
RAB9A P51151 2/20 0.58
NPC1 O15118 1/20 0.58
ALDH1A1 P00352 3/20 0.56
MAPK1 P28482 1/20 0.56
GABRA1 P14867 1/20 0.56
GABRB2 P47870 1/20 0.56
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
POLB P06746 1/20 0.50
SRD5A2 P31213 1/20 0.50
CTNNB1 P35222 1/20 0.50
WNT3A P56704 1/20 0.50
TSHR P16473 2/20 0.49
KDM4E B2RXH2 1/20 0.49
LMNA P02545 1/20 0.49

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
SCHEMBL17888022 0.91 TSHR (0.57) HPGDRAB9ANPC1ALDH1A1MEN1
SCHEMBL12988856 0.86 GABRA1 (0.72) HPGDRAB9ANPC1ALDH1A1MAPK1
SCHEMBL31151793 0.83 HPGD (0.65) HPGDRAB9ANPC1ALDH1A1MAPK1
SCHEMBL8573730 0.83 HPGD (0.65) HPGDRAB9ANPC1ALDH1A1MAPK1
SCHEMBL109220 0.79 HPGD (0.70) HPGDRAB9ANPC1ALDH1A1MAPK1
SCHEMBL25859869 0.79 HPGD (0.55) HPGDRAB9ANPC1ALDH1A1MAPK1
SCHEMBL25859487 0.79 HPGD (0.55) HPGDRAB9ANPC1ALDH1A1MAPK1
SCHEMBL11629969 0.78 ALDH1A1 (0.65) HPGDRAB9ANPC1ALDH1A1MAPK1
SCHEMBL25745395 0.78 ALDH1A1 (0.56) HPGDRAB9ANPC1ALDH1A1MAPK1
SCHEMBL25745388 0.78 ALDH1A1 (0.56) HPGDRAB9ANPC1ALDH1A1MAPK1

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-20080015179-A1 Modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED 2008-01-17 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-20080015179-A1 Modulators of muscarinic receptors CHRM3, CHRM5, CHRM2 HPGD 1197/4885RAB9A 1944/4885NPC1 1160/4885

“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.