Modafinil

Modafinil

SCHEMBL3908867

CO.NC(=O)C[S+]([O-])C(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC6A3

The experimentally established mechanism targets of Modafinil. 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
SLC6A3 known ✓ Q01959 3/20 0.41
EPHX1 P07099 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
PKM P14618 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CYP2C19 P33261 3/20 0.41
DRD3 P35462 2/20 0.41
LMNA P02545 2/20 0.41
ADORA3 P0DMS8 1/20 0.41
EDNRB P24530 1/20 0.41
MAPK1 P28482 1/20 0.41
MC4R P32245 1/20 0.41
MC3R P41968 1/20 0.41
DRD2 P14416 1/20 0.41
ALOX5 P09917 1/20 0.39
BCAT2 O15382 1/20 0.38
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37

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
Modafinil SCHEMBL3238686 0.96 CYP2D6 (0.44) EPHX1CYP1A2CYP2D6PKMSMN1; SMN2
Armodafinil SCHEMBL34489 0.96 CYP2D6 (0.44) EPHX1CYP1A2CYP2D6PKMSMN1; SMN2
Modafinil SCHEMBL1560974 0.96 CYP2D6 (0.44) EPHX1CYP1A2CYP2D6PKMSMN1; SMN2
(S)-Modafinil SCHEMBL1403524 0.96 CYP2D6 (0.44) EPHX1CYP1A2CYP2D6PKMSMN1; SMN2
Modafinil SCHEMBL34488 0.96 CYP2D6 (0.44) EPHX1CYP1A2CYP2D6PKMSMN1; SMN2
Modafinil SCHEMBL3914634 0.95 PKM (0.41) EPHX1CYP1A2CYP2D6PKMSMN1; SMN2
Modafinil SCHEMBL3921259 0.95 PKM (0.41) EPHX1CYP1A2CYP2D6PKMSMN1; SMN2
Modafinil SCHEMBL19025521 0.95 PKM (0.41) EPHX1CYP1A2CYP2D6PKMSMN1; SMN2
Modafinil SCHEMBL193837 0.92 CYP2D6 (0.41) EPHX1CYP1A2CYP2D6PKMSMN1; SMN2
Modafinil SCHEMBL193927 0.91 ALDH1A1 (0.40) EPHX1CYP1A2CYP2D6PKMSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101972240-A Modafinil Composition CEPHALON INC 2011-02-16 CN claimed
US-7566805-B2 Modafinil compositions CEPHALON, INC. (US) 2009-07-28 US claimed
EP-1670753-A4 MODAFINIL COMPOSITIONS CEPHALON INC (US) 2008-01-02 EP claimed
US-20070021510-A1 Modafinil compositions CEPHALON, INC. (US) 2007-01-25 US claimed
EP-1670753-A2 MODAFINIL COMPOSITIONS CEPHALON, INC. (US) 2006-06-21 EP claimed
WO-2005023198-A2 MODAFINIL COMPOSITIONS CEPHALON, INC. (US) 2005-03-17 WO claimed
CN-101972240-B Modafinil composition CEPHALON INC 2012-07-25 CN disclosed
CN-101972240-A Modafinil Composition CEPHALON INC 2011-02-16 CN disclosed
US-7566805-B2 Modafinil compositions CEPHALON, INC. (US) 2009-07-28 US disclosed
EP-1670753-A4 MODAFINIL COMPOSITIONS CEPHALON INC (US) 2008-01-02 EP disclosed
US-20070021510-A1 Modafinil compositions CEPHALON, INC. (US) 2007-01-25 US disclosed
EP-1670753-A2 MODAFINIL COMPOSITIONS CEPHALON, INC. (US) 2006-06-21 EP disclosed
WO-2005023198-A2 MODAFINIL COMPOSITIONS CEPHALON, INC. (US) 2005-03-17 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-20070021510-A1 Modafinil compositions CYP3A4, COMT, CYP3A43 SLC6A3 58/4885EPHX1 3927/4885CYP1A2 46/4885

“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.