SCHEMBL16759547

SCHEMBL16759547

CC(C)(C)OC(=O)c1cc(C2CC2)c(CN2CCC(Oc3ccc(C(F)(F)F)cc3)CC2)cc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 2/20 0.46
▸ SCN7A Q01118 2/20 0.42
▸ SCN5A Q14524 2/20 0.42
▸ LIPE Q05469 2/20 0.42
▸ SCN9A Q15858 2/20 0.42
▸ SCN1A P35498 1/20 0.42
▸ SCN4A P35499 1/20 0.42
▸ SCN2A Q99250 1/20 0.42
▸ SCN3A Q9NY46 1/20 0.42
▸ SCN8A Q9UQD0 1/20 0.42
▸ FFAR1 O14842 1/20 0.40
▸ MMP2 P08253 3/20 0.40
▸ MMP13 P45452 3/20 0.40
▸ PRKAA2 P54646 1/20 0.39
▸ PLA2G1B P04054 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ ATG4B Q9Y4P1 1/20 0.39
▸ LIPG Q9Y5X9 2/20 0.39
▸ LIPC P11150 1/20 0.39
▸ EPHX2 P34913 1/20 0.39

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
SCHEMBL16758919 0.92 ADRB2 (0.44) ADRB2SCN7ASCN5ASCN9APLA2G1B
SCHEMBL16759166 0.91 FFAR1 (0.46) SCN7ASCN5ASCN9ASCN1ASCN4A
SCHEMBL16759619 0.90 SCN9A (0.44) ADRB2SCN7ASCN5ASCN9ASCN1A
SCHEMBL16771087 0.88 ADRB2 (0.49) ADRB2SCN7ASCN5ALIPESCN9A
SCHEMBL16771104 0.88 SCN9A (0.42) ADRB2SCN7ASCN5ASCN9ASCN1A
SCHEMBL16759502 0.88 LIPE (0.55) SCN7ASCN5ALIPESCN9ASCN1A
SCHEMBL16771051 0.87 ADRB2 (0.48) ADRB2SCN7ASCN5ALIPESCN9A
SCHEMBL16758975 0.87 CCR3 (0.49) ADRB2SCN7ASCN5ASCN9ASCN1A
SCHEMBL16759257 0.86 SCN9A (0.51) ADRB2SCN7ASCN5ASCN9ASCN1A
Trifluoroacetic Acid SCHEMBL28338837 0.86 ADRB2 (0.47) ADRB2SCN7ASCN5ALIPESCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210093618-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-04-01 — — US disclosed
US-20210093618-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-04-01 — — US disclosed
US-20200108054-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2020-04-09 — — US disclosed
CN-105793238-B Substituted benzamides and methods of use thereof 基因泰克公司 2019-12-24 — — CN disclosed
US-9694002-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-07-04 — — US disclosed
US-9694002-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-07-04 — — US disclosed
US-9694002-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-07-04 — — US disclosed
US-20170087136-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-03-30 — — US disclosed
US-20170087136-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-03-30 — — US disclosed
US-20170087136-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-03-30 — — US disclosed
US-9546164-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-01-17 — — US disclosed
US-9546164-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-01-17 — — US disclosed
US-9546164-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-01-17 — — US disclosed
EP-3074377-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF Genentech, Inc. (US) 2016-10-05 — — EP disclosed
US-20150252038-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF XENON PHARMACEUTICALS INC. (CA) 2015-09-10 — — US disclosed
US-20150252038-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF XENON PHARMACEUTICALS INC. (CA) 2015-09-10 — — US disclosed
US-20150252038-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF XENON PHARMACEUTICALS INC. (CA) 2015-09-10 — — US disclosed
WO-2015078374-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2015-06-04 — — WO disclosed
WO-2015078374-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2015-06-04 — — 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 (4 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-20210093618-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, SULT2A1 ADRB2 913/4885SCN7A 1270/4885SCN5A 628/4885
US-20150252038-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, RRM1 ADRB2 802/4885SCN7A 1496/4885SCN5A 640/4885
US-20170087136-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF C1R, SRR, PNISR ADRB2 1620/4885SCN7A 258/4885SCN5A 631/4885
US-20200108054-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, SULT2A1 ADRB2 913/4885SCN7A 1270/4885SCN5A 628/4885

“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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