SCHEMBL2565147

SCHEMBL2565147

CCCc1cc(C(F)(F)F)ccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.47
CTSK P43235 1/20 0.47
SLC6A4 P31645 4/20 0.44
SLC6A2 P23975 1/20 0.44
KCNH2 Q12809 4/20 0.43
HTR2A P28223 3/20 0.43
PDE2A O00408 2/20 0.42
HRH4 Q9H3N8 1/20 0.40
PPARG P37231 1/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
GABRA2 P47869 2/20 0.40
GABRB2 P47870 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
GABRB3 P28472 3/20 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
SCHEMBL3105504 0.89 GABRA2 (0.43) CTSSCTSKSLC6A4SLC6A2KCNH2
SCHEMBL10050765 0.85 SLC6A4 (0.46) SLC6A4SLC6A2KCNH2HTR2APDE2A
SCHEMBL25977970 0.82 PPARG (0.43) CTSSCTSKSLC6A4KCNH2HTR2A
SCHEMBL25090301 0.81 SLC6A4 (0.41) SLC6A4SLC6A2KCNH2HTR2APDE2A
SCHEMBL25090457 0.81 SLC6A4 (0.41) SLC6A4SLC6A2KCNH2HTR2APDE2A
SCHEMBL14157106 0.81 TAAR1 (0.50) SLC6A4SLC6A2KCNH2HTR2APDE2A
Ammonia Solution, Strong SCHEMBL4339853 0.81 PPARG (0.42) CTSSCTSKSLC6A4KCNH2HTR2A
SCHEMBL10656350 0.80 SLC6A4 (0.48) SLC6A4SLC6A2KCNH2HTR2APDE2A
Ethylamine SCHEMBL4235858 0.80 SLC6A4 (0.43) CTSSCTSKSLC6A4SLC6A2KCNH2
SCHEMBL4242538 0.80 KCNH2 (0.46) CTSSCTSKSLC6A4SLC6A2KCNH2

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
WO-2023028056-A1 3-AMINO PIPERIDYL SODIUM CHANNEL INHIBITORS GENENTECH, INC. (US) 2023-03-02 WO disclosed
US-20210093618-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-04-01 US disclosed
US-10005732-B2 Potent non-urea inhibitors of soluble epoxide hydrolase THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2018-06-26 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
WO-2015078374-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2015-06-04 WO disclosed
EP-2560978-A1 INHIBITORS OF ARGINASE AND THEIR THERAPEUTIC APPLICATIONS Mars, Incorporated (US) 2013-02-27 EP disclosed
WO-2011133653-A1 INHIBITORS OF ARGINASE AND THEIR THERAPEUTIC APPLICATIONS MARS, INCORPORATED (US) 2011-10-27 WO disclosed
US-20100331348-A1 TROPANE DERIVATIVES USEFUL AS PESTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-12-30 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 (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 CTSS 936/4885CTSK 2183/4885SLC6A4 1222/4885
US-20100331348-A1 TROPANE DERIVATIVES USEFUL AS PESTICIDES DDT, ACHE, TPM3 CTSS 1075/4885CTSK 2107/4885SLC6A4 1912/4885
US-20170087136-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF C1R, SRR, PNISR CTSS 943/4885CTSK 2084/4885SLC6A4 661/4885
US-10005732-B2 Potent non-urea inhibitors of soluble epoxide hydrolase EPHX1, EPHX2, ECE1 CTSS 1620/4885CTSK 1897/4885SLC6A4 3291/4885

“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.