SCHEMBL1998581

SCHEMBL1998581

CC1c2c(ccc3[nH]cc(Cl)c23)OCCN1C(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.34
ATM Q13315 2/20 0.33
USP30 Q70CQ3 1/20 0.33
ALDH1A1 P00352 2/20 0.32
TSHR P16473 2/20 0.32
PARP1 P09874 1/20 0.32
LMNA P02545 1/20 0.32
USP2 O75604 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
IL1B P01584 1/20 0.32
P2RX7 Q99572 1/20 0.32
MAPT P10636 1/20 0.31
STS P08842 1/20 0.31
GPR119 Q8TDV5 1/20 0.31
GRM5 P41594 1/20 0.31

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
SCHEMBL1999535 0.81 CREBBP (0.36) ATMUSP30PARP1P2RX7GPR119
Indole SCHEMBL4409752 0.75 IDO1 (0.36) USP30PARP1
SCHEMBL739962 0.70 MTNR1A (0.36) TSHRSMN1; SMN2
SCHEMBL4260447 0.69 HTR2A (0.38) USP30USP2SMN1; SMN2GPR119
SCHEMBL29501163 0.69 HCRTR2 (0.43) ATMUSP30LMNASMN1; SMN2GPR119
SCHEMBL17958021 0.69 HCRTR2 (0.43) ATMUSP30LMNASMN1; SMN2GPR119
SCHEMBL1997467 0.69 ALDH1A1 (0.38) ALDH1A1TSHRLMNASMN1; SMN2MAPT
SCHEMBL12553797 0.68 ATM (0.44) ATMALDH1A1USP2SMN1; SMN2MAPT
SCHEMBL16004452 0.68 USP30 (0.38) OPRK1ATMUSP30ALDH1A1LMNA
SCHEMBL17958028 0.67 USP30 (0.40) ATMUSP30GRM5

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 4 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
EP-2091953-A1 8-SULFONYL-L, 3, 4, 8-TETRAHYDR0-2H- [1, 4]OXAZEPINO [6, 7-E]INDOLE DERIVATIVES AND THEIR USE AS 5-HT6 RECEPTOR LIGANDS BIOVITRUM AB (publ) (SE) 2009-08-26 EP disclosed
US-20080176829-A1 Compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-07-24 US disclosed
WO-2008054288-A1 8-SULFONYL-L, 3, 4, 8-TETRAHYDR0-2H- [1, 4] OXAZEPINO [6, 7-E] INDOLE DERIVATIVES AND THEIR USE AS 5-HT6 RECEPTOR LIGANDS BIOVITRUM AB (PUBL) (SE) 2008-05-08 WO 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 OPRK1 35/4885ATM 4008/4885USP30 3930/4885

“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.