SCHEMBL16463395

SCHEMBL16463395

CCCN(C(=O)c1ccccc1C(F)(F)F)C1CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 14/20 0.53
▸ SLC6A2 P23975 13/20 0.53
▸ SLC6A3 Q01959 7/20 0.51
▸ CHRM4 P08173 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CHRM5 P08912 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ KCNH2 Q12809 2/20 0.45
▸ TRPM8 Q7Z2W7 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ LMNA P02545 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ UBE2M P61081 1/20 0.42
▸ DCUN1D1 Q96GG9 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
SCHEMBL16464321 0.81 SLC6A4 (0.62) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL10726904 0.80 SLC6A4 (0.54) SLC6A4SLC6A2SLC6A3KCNH2TRPM8
SCHEMBL13434170 0.78 POLQ (0.54) SLC6A4SLC6A2SLC6A3
SCHEMBL13434159 0.76 SLC6A4 (0.58) SLC6A4SLC6A2SLC6A3KCNH2TRPM8
SCHEMBL4469871 0.74 TSHR (0.50) SLC6A4SLC6A2SLC6A3TP53LMNA
SCHEMBL4560310 0.72 SLC6A4 (0.62) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL16487401 0.72 SMN1; SMN2 (0.58) SLC6A4SLC6A2SLC6A3CHRM4CYP3A4
SCHEMBL13911241 0.72 SLC6A4 (0.56) SLC6A4SLC6A2KCNH2TRPM8
SCHEMBL10724404 0.71 TRPM8 (0.55) SLC6A4SLC6A2SLC6A3TRPM8TP53
SCHEMBL16465413 0.71 KCNA5 (0.40) SLC6A4SLC6A2SLC6A3CYP3A4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200054630-A1 BENZAMIDES-CONTAINING COMPOUNDS AND THEIR USE IN THE TREATMENT OF DEPRESSION MINDIMMUNE THERAPEUTICS, INC. 2020-02-20 — — US disclosed
US-10238654-B2 Benzamides-containing compounds and their use in the treatment of epilepsy MINDIMMUNE THERAPEUTICS, INC. (US) 2019-03-26 — — US disclosed
US-20170202836-A1 Benzamides-Containing Compounds and Their Use in the Treatment of Epilepsy H. LUNDBECK A/S (DK) 2017-07-20 — — US disclosed
US-9649308-B2 Benzamide-containing compounds and their use in the treatment of pain H. LUNDBECK A/S (DK) 2017-05-16 — — US disclosed
US-20150283134-A1 Benzamides MINDIMMUNE THERAPEUTICS, INC. 2015-10-08 — — US disclosed
EP-2906546-A1 BENZAMIDES H. Lundbeck A/S (DK) 2015-08-19 — — EP disclosed
US-9102591-B2 Benzamides H. LUNDBECK A/S (DK) 2015-08-11 — — US disclosed
WO-2014057078-A1 BENZAMIDES H. LUNDBECK A/S (DK) 2014-04-17 — — WO disclosed
US-20140107340-A1 Benzamides H. LUNDBECK A/S (DK) 2014-04-17 — — 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 (5 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-20200054630-A1 BENZAMIDES-CONTAINING COMPOUNDS AND THEIR USE IN THE TREATMENT OF DEPRESSION P2RX5, P2RX7, P2RX2 SLC6A4 81/4885SLC6A2 227/4885SLC6A3 349/4885
US-20140107340-A1 Benzamides P2RX7, TRPV1, P2RX5 SLC6A4 432/4885SLC6A2 1000/4885SLC6A3 954/4885
US-10238654-B2 Benzamides-containing compounds and their use in the treatment of epilepsy P2RX5, P2RX7, P2RX6 SLC6A4 554/4885SLC6A2 784/4885SLC6A3 1126/4885
US-20170202836-A1 Benzamides-Containing Compounds and Their Use in the Treatment of Epilepsy P2RX5, P2RX7, P2RX6 SLC6A4 554/4885SLC6A2 784/4885SLC6A3 1126/4885
US-20150283134-A1 Benzamides P2RX7, TRPV1, P2RX5 SLC6A4 432/4885SLC6A2 1000/4885SLC6A3 954/4885

“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.

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