SCHEMBL6161940

SCHEMBL6161940

CC(C)(C)OC(=O)[C@H]1C[C@@H]1C1CCN(C(=O)OCc2ccccc2)C1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.53
JAK1 P23458 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
CYP2C19 P33261 1/20 0.48
HTT P42858 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
GPR119 Q8TDV5 2/20 0.45
GRIN2B Q13224 3/20 0.44
CYP2D6 P10635 2/20 0.44
CYP2C9 P11712 2/20 0.44
HSD11B1 P28845 2/20 0.44
PARP1 P09874 1/20 0.43
PDE4B Q07343 1/20 0.43
XIAP P98170 1/20 0.42
BIRC2 Q13490 1/20 0.42
USP30 Q70CQ3 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
SCHEMBL6159410 1.00 JAK2 (0.53) JAK2JAK1SMN1; SMN2NPC1RAB9A
SCHEMBL6159416 1.00 JAK2 (0.53) JAK2JAK1SMN1; SMN2NPC1RAB9A
SCHEMBL21143479 0.85 SMN1; SMN2 (0.54) JAK2JAK1SMN1; SMN2NPC1RAB9A
SCHEMBL30960033 0.84 JAK2 (0.61) JAK2JAK1SMN1; SMN2NPC1RAB9A
SCHEMBL30959962 0.84 JAK2 (0.61) JAK2JAK1SMN1; SMN2NPC1RAB9A
SCHEMBL26100843 0.84 GPR119 (0.61) JAK2JAK1SMN1; SMN2NPC1RAB9A
SCHEMBL30960004 0.84 JAK2 (0.61) JAK2JAK1SMN1; SMN2NPC1RAB9A
SCHEMBL30965696 0.84 GPR119 (0.61) JAK2JAK1SMN1; SMN2NPC1RAB9A
SCHEMBL26101361 0.84 GPR119 (0.61) JAK2JAK1SMN1; SMN2NPC1RAB9A
SCHEMBL26101527 0.84 GPR119 (0.61) JAK2JAK1SMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6949662-B2 Cis-substituted aminocyclopropane derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-27 US disclosed
EP-0919553-B1 cis-SUBSTITUTED AMINOCYCLOPROPANE DERIVATIVES DAIICHI SEIYAKU CO (JP) 2005-03-02 EP disclosed
US-20020183523-A1 Cis-substituted aminocyclopropane derivative DAIICHI PHARMACEUTICAL CO., LTD 2002-12-05 US disclosed
US-6462040-B1 MICROBIOCIDES; BACTERIOCIDES; ANTIPROTOZOA AGENTS; QUINOLONE ANTIBIOTICS; SIDE EFFECT REDUCTION; ANTIBIOTIC-RESISTANT BACTERIA INCLUDING STAPHYLOCCOCUS; VETERINARY MEDICINE DAIICHO PHARMACEUTICAL CO., LTD. (JP) 2002-10-08 US disclosed
US-6391889-B2 POTENT ANTIMICROBIAL ACTIVITY ON BROAD RANGE OF MICROORGANISMS, E.G., STAPHYLOCOCCUS, GRAMPOSITIVE BACTERIA AND QUINOLONE ANTIBIOTIC RESISTANCE; SIDE EFFECT REDUCTION; NONTOXIC DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2002-05-21 US disclosed
US-20020052502-A1 Cis-substituted aminocyclopropane derivative DAIICHI PHARMACEUTICAL CO., LTD. 2002-05-02 US disclosed
US-20020002182-A1 CIS-SUBSTITUTED AMINOCYCLOPROPANE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2002-01-03 US disclosed
EP-0919553-A1 cis-SUBSTITUTED AMINOCYCLOPROPANE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-06-02 EP 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 (3 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-20020052502-A1 Cis-substituted aminocyclopropane derivative SLC11A2, MYD88, ARG1 JAK2 3101/4885JAK1 3801/4885SMN1; SMN2 3810/4885
US-20020002182-A1 CIS-SUBSTITUTED AMINOCYCLOPROPANE DERIVATIVES PHOSPHO1, CCR2, ECH1 JAK2 3401/4885JAK1 4119/4885SMN1; SMN2 4640/4885
US-20020183523-A1 Cis-substituted aminocyclopropane derivative SLC11A2, MYD88, ARG1 JAK2 3101/4885JAK1 3801/4885SMN1; SMN2 3810/4885

“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.