Sertraline

Sertraline

SCHEMBL6284080

CC(C)O.CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21.Cl

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC6A4

The experimentally established mechanism targets of Sertraline. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 6/20 0.85
MEN1 O00255 5/20 0.88
KMT2A Q03164 5/20 0.88
CYP3A4 P08684 5/20 0.88
TP53 P04637 4/20 0.88
MAPT P10636 3/20 0.88
MAPK1 P28482 3/20 0.88
GMNN O75496 2/20 0.88
LMNA P02545 2/20 0.88
PMP22 Q01453 2/20 0.88
TSHR P16473 2/20 0.88
NFKB1 P19838 2/20 0.88
THPO P40225 2/20 0.88
ALOX15 P16050 1/20 0.88
SMN1; SMN2 Q16637 1/20 0.88
SLC6A2 P23975 6/20 0.85
SLC6A3 Q01959 6/20 0.85
CYP1A2 P05177 3/20 0.85
CYP2C19 P33261 3/20 0.85
NPC1 O15118 2/20 0.85

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
Sertraline SCHEMBL5531496 0.94 MEN1 (0.95) MEN1KMT2ACYP3A4TP53MAPT
Sertraline SCHEMBL3866334 0.94 MEN1 (1.00) MEN1KMT2ACYP3A4TP53MAPT
Sertraline SCHEMBL6701905 0.94 MEN1 (1.00) MEN1KMT2ACYP3A4TP53MAPT
Sertraline SCHEMBL29406979 0.94 MEN1 (1.00) MEN1KMT2ACYP3A4TP53MAPT
Sertraline SCHEMBL23230 0.94 MEN1 (1.00) MEN1KMT2ACYP3A4TP53MAPT
Sertraline SCHEMBL7327367 0.94 MEN1 (1.00) MEN1KMT2ACYP3A4TP53MAPT
Sertraline SCHEMBL33371 0.94 MEN1 (1.00) MEN1KMT2ACYP3A4TP53MAPT
Sertraline SCHEMBL1560715 0.94 MEN1 (1.00) MEN1KMT2ACYP3A4TP53MAPT
Sertraline SCHEMBL4963372 0.94 MEN1 (1.00) MEN1KMT2ACYP3A4TP53MAPT
Sertraline SCHEMBL29895228 0.94 MEN1 (1.00) MEN1KMT2ACYP3A4TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1384816-A Polymorphic forms of sertraline hydrochloride CIBA SC HOLDING AG (CH) 2002-12-11 CN claimed
EP-1224160-A1 POLYMORPHIC FORMS OF SERTRALINE HYDROCHLORIDE Ciba SC Holding AG (CH) 2002-07-24 EP claimed
WO-2001032601-A1 POLYMORPHIC FORMS OF SERTRALINE HYDROCHLORIDE CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-05-10 WO claimed
CN-112552188-A Process for the preparation of sertraline hydrochloride form I 山西仟源医药集团股份有限公司 2021-03-26 CN disclosed
US-6939992-B2 Polymorphic forms of sertraline hydrochloride CIBA SPECIALTY CHEMICALS CORPORATION (US) 2005-09-06 US disclosed
US-6872853-B1 Polymorphic forms of sertraline hydrochloride CIBA SPECIALTY CHEMICALS CORPORATION (US) 2005-03-29 US disclosed
US-20040132828-A1 Polymorphic forms of sertraline hydrochloride VAN DER SCHAAF PAUL ADRIAAN (CH) 2004-07-08 US disclosed
CN-1384816-A Polymorphic forms of sertraline hydrochloride CIBA SC HOLDING AG (CH) 2002-12-11 CN disclosed
EP-1224160-A1 POLYMORPHIC FORMS OF SERTRALINE HYDROCHLORIDE Ciba SC Holding AG (CH) 2002-07-24 EP disclosed
WO-2001032601-A1 POLYMORPHIC FORMS OF SERTRALINE HYDROCHLORIDE CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-05-10 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 (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-20040132828-A1 Polymorphic forms of sertraline hydrochloride SLC6A4, SLC6A2, SPIN1 SLC6A4 1/4885MEN1 2698/4885KMT2A 2903/4885

“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.