SCHEMBL3323624

SCHEMBL3323624

CC12CC3CC(C)(C1)CC(C(=O)NCCc1cccs1)(C3)C2

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.70
NPC1 O15118 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.51
POLB P06746 2/20 0.51
RAB9A P51151 3/20 0.46
CYP3A4 P08684 1/20 0.46
KMT2A Q03164 1/20 0.45
METAP2 P50579 3/20 0.43
TAAR1 Q96RJ0 1/20 0.43
EPHX2 P34913 1/20 0.42
ADAM17 P78536 1/20 0.42
GAA P10253 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL3320033 0.88 HSD11B1 (0.69) HSD11B1NPC1SMN1; SMN2POLBCYP3A4
SCHEMBL13333009 0.83 HSD11B1 (1.00) HSD11B1NPC1SMN1; SMN2POLBRAB9A
SCHEMBL13361609 0.80 HSD11B1 (0.88) HSD11B1NPC1SMN1; SMN2POLBRAB9A
SCHEMBL3321884 0.79 HSD11B1 (0.78) HSD11B1NPC1SMN1; SMN2RAB9ACYP3A4
SCHEMBL13950152 0.78 HSD11B1 (0.61) HSD11B1NPC1SMN1; SMN2RAB9ACYP3A4
SCHEMBL3321983 0.76 HSD11B1 (0.61) HSD11B1NPC1SMN1; SMN2POLBRAB9A
SCHEMBL3455073 0.73 POLB (0.74) HSD11B1NPC1SMN1; SMN2POLBKMT2A
SCHEMBL3323868 0.73 HSD11B1 (0.59) HSD11B1NPC1SMN1; SMN2POLBRAB9A
SCHEMBL3322991 0.72 HSD11B1 (0.75) HSD11B1NPC1SMN1; SMN2RAB9ACYP3A4
SCHEMBL12858257 0.71 SMN1; SMN2 (0.73) NPC1SMN1; SMN2POLBKMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100120789-A1 Compound STERIX LIMITED (GB) 2010-05-13 US disclosed
US-20100120789-A1 Compound STERIX LIMITED (GB) 2010-05-13 US disclosed
US-20100120789-A1 Compound STERIX LIMITED (GB) 2010-05-13 US disclosed
US-20090042929-A1 11-Beta-Hydroxysteroid Dehydrogenase Inhibitors STERIX LIMITED (GB) 2009-02-12 US disclosed
US-20090042929-A1 11-Beta-Hydroxysteroid Dehydrogenase Inhibitors STERIX LIMITED (GB) 2009-02-12 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 (2 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-20090042929-A1 11-Beta-Hydroxysteroid Dehydrogenase Inhibitors HSD3B1, HSD3B2, HSD11B1 HSD11B1 3/4885NPC1 1106/4885SMN1; SMN2 4801/4885
US-20100120789-A1 Compound NR0B2, NR0B1, NR4A1 HSD11B1 73/4885NPC1 2474/4885SMN1; SMN2 4612/4885

“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.