SCHEMBL18945971

SCHEMBL18945971

N[C@@H](C(=O)O)c1cccc(OC(F)(F)F)c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.47
GPR139 Q6DWJ6 1/20 0.44
CTSA P10619 1/20 0.43
EPHX1 P07099 2/20 0.43
MEN1 O00255 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GRM8 O00222 1/20 0.42
GRM6 O15303 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
DRD3 P35462 1/20 0.42
GRM4 Q14833 1/20 0.42
NOTUM Q6P988 1/20 0.42
FFAR1 O14842 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
SCHEMBL21272703 1.00 TRPM8 (0.47) TRPM8GPR139CTSAEPHX1MEN1
SCHEMBL31177472 1.00 TRPM8 (0.47) TRPM8GPR139CTSAEPHX1MEN1
SCHEMBL18945364 1.00 TRPM8 (0.47) TRPM8GPR139CTSAEPHX1MEN1
Hydrochloric Acid SCHEMBL21272696 0.98 TRPM8 (0.46) TRPM8GPR139CTSAEPHX1MEN1
Hydrochloric Acid SCHEMBL21272695 0.98 TRPM8 (0.46) TRPM8GPR139CTSAEPHX1MEN1
SCHEMBL761250 0.84 TRPM8 (0.46) TRPM8GPR139CTSANOTUMFFAR1
SCHEMBL1275951 0.84 CTSA (0.47) TRPM8GPR139CTSANOTUMFFAR1
SCHEMBL28243724 0.84 KMT2A (0.45) MEN1CYP2D6CYP2C9CYP2C19KMT2A
SCHEMBL31177417 0.84 GPR139 (0.45) TRPM8GPR139EPHX1
SCHEMBL7472717 0.83 TRPM8 (0.45) TRPM8GPR139CTSANOTUMFFAR1

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116589375-A Alcohol derivatives as Kv7 potassium channel openers H.隆德贝克有限公司 2023-08-15 CN disclosed
CN-111727182-B Alcohol derivatives as Kv7 potassium channel openers H.隆德贝克有限公司 2023-05-26 CN disclosed
US-11548849-B2 Alcohol derivatives as KV7 potassium channel openers H. LUNDBECK A/S (DK) 2023-01-10 US disclosed
US-20220280455-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS FOR USE IN EPILEPSY OR SEIZURES H. LUNDBECK A/S (DK) 2022-09-08 US disclosed
CN-114206328-A Alcohol derivatives as Kv7 potassium channel openers for use in epilepsy or seizures H.隆德贝克有限公司 2022-03-18 CN disclosed
CN-114206830-A Alcohol derivatives as Kv7 potassium channel openers H.隆德贝克有限公司 2022-03-18 CN disclosed
US-20210032196-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H. LUNDBECK A/S (DK) 2021-02-04 US disclosed
EP-3755684-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H. Lundbeck A/S (DK) 2020-12-30 EP disclosed
CN-111727182-A Alcohol derivatives as Kv7 potassium channel openers H.隆德贝克有限公司 2020-09-29 CN disclosed
US-20200172474-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H. LUNDBECK A/S (DK) 2020-06-04 US disclosed
US-10590067-B2 Alcohol derivatives of carboxamides as Kv7 potassium channel openers H. LUNDBECK A/S (DK) 2020-03-17 US disclosed
WO-2019161877-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H. LUNDBECK A/S (DK) 2019-08-29 WO disclosed
US-20190256456-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H. LUNDBECK A/S (DK) 2019-08-22 US disclosed
US-10040789-B2 1,3,4-thiadiazole compounds and their use in treating cancer ASTRAZENECA AB (SE) 2018-08-07 US disclosed
US-10040789-B2 1,3,4-thiadiazole compounds and their use in treating cancer ASTRAZENECA AB (SE) 2018-08-07 US disclosed
US-10040789-B2 1,3,4-thiadiazole compounds and their use in treating cancer ASTRAZENECA AB (SE) 2018-08-07 US disclosed
US-20170333429-A1 1,3,4-Thiadiazole Compounds and Their Use in Treating Cancer ASTRAZENECA AB (SE) 2017-11-23 US disclosed
US-20170333429-A1 1,3,4-Thiadiazole Compounds and Their Use in Treating Cancer ASTRAZENECA AB (SE) 2017-11-23 US disclosed
US-20170333429-A1 1,3,4-Thiadiazole Compounds and Their Use in Treating Cancer ASTRAZENECA AB (SE) 2017-11-23 US disclosed
WO-2017093301-A1 1,3,4-THIADIAZOLE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2017-06-08 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 (8 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-11548849-B2 Alcohol derivatives as KV7 potassium channel openers KCNA7, KCNK17, KCNAB1 TRPM8 82/4885GPR139 592/4885CTSA 2893/4885
US-20220280455-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS FOR USE IN EPILEPSY OR SEIZURES KCNA7, KCNQ5, KCNQ2 TRPM8 100/4885GPR139 475/4885CTSA 1989/4885
US-20170333429-A1 1,3,4-Thiadiazole Compounds and Their Use in Treating Cancer GLS2, GLS, GLRX3 TRPM8 4432/4885GPR139 3364/4885CTSA 3181/4885
US-20190256456-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS KCNA7, KCNK17, KCNQ1 TRPM8 65/4885GPR139 663/4885CTSA 2451/4885
US-10040789-B2 1,3,4-thiadiazole compounds and their use in treating cancer GLS2, GLS, GLRX3 TRPM8 4432/4885GPR139 3364/4885CTSA 3181/4885
US-10590067-B2 Alcohol derivatives of carboxamides as Kv7 potassium channel openers KCNA7, KCNQ5, KCNQ1 TRPM8 83/4885GPR139 480/4885CTSA 2804/4885
US-20210032196-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS KCNA7, KCNK17, KCNQ1 TRPM8 65/4885GPR139 663/4885CTSA 2451/4885
US-20200172474-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS KCNA7, KCNK17, KCNQ1 TRPM8 65/4885GPR139 663/4885CTSA 2451/4885

“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.