SCHEMBL5848289

SCHEMBL5848289

CC(NC(=O)C1CC1c1cc(F)ccc1F)c1ccc2ccccc2c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 3/20 0.48
MMP9 P14780 1/20 0.46
CHRNA7 P36544 3/20 0.41
PRCP P42785 1/20 0.41
PDE2A O00408 2/20 0.40
METAP2 P50579 1/20 0.40
METAP1 P53582 1/20 0.40
FFAR1 O14842 1/20 0.40
ALDH1A1 P00352 2/20 0.39
HCRTR1 O43613 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KCNQ3 O43525 1/20 0.38
KCNQ2 O43526 1/20 0.38
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL30794634 1.00 GPR88 (0.48) GPR88MMP9CHRNA7PRCPPDE2A
SCHEMBL30795024 0.86 GPR88 (0.59) GPR88MMP9CHRNA7PRCPPDE2A
SCHEMBL5849173 0.86 GPR88 (0.59) GPR88MMP9CHRNA7PRCPPDE2A
SCHEMBL5849180 0.85 GPR88 (0.69) GPR88CHRNA7PRCPFFAR1KCNQ3
SCHEMBL30794540 0.85 GPR88 (0.69) GPR88CHRNA7PRCPFFAR1KCNQ3
SCHEMBL5848195 0.79 ACACB (0.45) PRCP
SCHEMBL5848169 0.77 ACKR3 (0.42) GPR88
SCHEMBL30824709 0.77 ACKR3 (0.42) GPR88
SCHEMBL5848011 0.75 GPR88 (0.72) GPR88CHRNA7PRCPKCNQ3KCNQ2
SCHEMBL30794633 0.75 GPR88 (0.72) GPR88CHRNA7PRCPKCNQ3KCNQ2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7144881-B2 Arylcyclopropylcarboxylic amides as potassium channel openers BRISTOL-MYERS SQUIBB COMPANY (US) 2006-12-05 US claimed
US-20040110754-A1 2-(2-fluoro-phenyl)-cyclopropanecarboxylic acid[1-(2,3-dihydro-benzofuran-5-yl)-ethyl]-amide for example; for pain, migraine, neuropathic pain, bipolar disorders, convulsions, mania, epilepsy, anxiety, depression and neurodegenerative disorders BRISTOL-MYERS SQUIBB COMPANY 2004-06-10 US claimed
WO-2024054807-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND TDP-43 MODULATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 WO disclosed
WO-2024050389-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND NMDA RECEPTOR ANTAGONISTS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-07 WO disclosed
US-7144881-B2 Arylcyclopropylcarboxylic amides as potassium channel openers BRISTOL-MYERS SQUIBB COMPANY (US) 2006-12-05 US disclosed
US-20040110754-A1 2-(2-fluoro-phenyl)-cyclopropanecarboxylic acid[1-(2,3-dihydro-benzofuran-5-yl)-ethyl]-amide for example; for pain, migraine, neuropathic pain, bipolar disorders, convulsions, mania, epilepsy, anxiety, depression and neurodegenerative disorders BRISTOL-MYERS SQUIBB COMPANY 2004-06-10 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-20040110754-A1 2-(2-fluoro-phenyl)-cyclopropanecarboxylic acid[1-(2,3-dihydro-benzofuran-5-yl)-ethyl]-amide for example; for pain, migraine, neuropathic pain, bipolar disorders, convulsions, mania, epilepsy, anxiety, depression and neurodegenerative disorders KCNQ2, KCNQ5, KCNJ2 GPR88 604/4885MMP9 3534/4885CHRNA7 148/4885

“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.