SCHEMBL1997743

SCHEMBL1997743

CC(C)(C)OC(=O)N1CCOc2ccc3[nH]ccc3c2C1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 2/20 0.43
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
C5AR1 P21730 1/20 0.40
MAPK1 P28482 1/20 0.39
ESR2 Q92731 1/20 0.37
JAK1 P23458 4/20 0.37
JAK2 O60674 2/20 0.37
TYK2 P29597 1/20 0.37
JAK3 P52333 1/20 0.37
NR1H2 P55055 2/20 0.37
USP30 Q70CQ3 1/20 0.36
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
F12 P00748 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
Indole SCHEMBL4414195 0.93 C5AR1 (0.43) CREBBPUSP2SMN1; SMN2C5AR1MAPK1
SCHEMBL2002050 0.82 CREBBP (0.46) CREBBP
SCHEMBL4260447 0.77 HTR2A (0.38) USP2SMN1; SMN2MAPK1ESR2NR1H2
SCHEMBL4410244 0.77 CREBBP (0.33) CREBBPC5AR1
SCHEMBL1999535 0.76 CREBBP (0.36) CREBBPJAK1JAK2TYK2JAK3
SCHEMBL19667310 0.75 USP2 (0.44) USP2SMN1; SMN2MAPK1ESR2NR1H2
SCHEMBL17813927 0.74 NR1H2 (0.44) USP2SMN1; SMN2C5AR1MAPK1ESR2
SCHEMBL17813928 0.74 USP2 (0.43) USP2SMN1; SMN2MAPK1ESR2NR1H2
SCHEMBL3276399 0.74 UCHL1 (0.44) USP2SMN1; SMN2MAPK1ESR2NR1H2
SCHEMBL22744298 0.74 POLB (0.43) CREBBPUSP2SMN1; SMN2MAPK1NR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960374-B2 e.g. 2,5-methylene-9-(phenylsulfonyl)-1,2,3,4,5,9-hexahydro[1,5]oxazocino[3,2-e]indole; serotonin receptors antagonist or partial agonist; metabolic diseases, e.g. obesity, insulin resisitance, type 2 diabetes, eating disorders; antidepressant, anxiolytic agent; cosmetics PROXIMAGEN LIMITED (GB) 2011-06-14 US disclosed
US-20080176829-A1 Compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-07-24 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-20080176829-A1 Compounds HTR6, HTR1B, HTR1A CREBBP 2723/4885USP2 4643/4885SMN1; SMN2 3150/4885

“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.