SCHEMBL2722680

SCHEMBL2722680

CNCCC(Oc1cccc2ccccc12)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 18/20 1.00
SLC6A2 P23975 16/20 1.00
CYP1A2 P05177 4/20 0.68
CYP3A4 P08684 4/20 0.68
CYP2D6 P10635 4/20 0.68
TSHR P16473 3/20 0.68
SLC6A3 Q01959 3/20 0.68
KMT2A Q03164 2/20 0.68
CHRM1 P11229 2/20 0.68
ADRA2B P18089 2/20 0.68
HTR2A P28223 2/20 0.68
HTR2C P28335 2/20 0.68
HRH1 P35367 2/20 0.68
OPRM1 P35372 2/20 0.68
DRD3 P35462 2/20 0.68
OPRK1 P41145 2/20 0.68
HTR2B P41595 2/20 0.68
KCNH2 Q12809 2/20 0.68
KLF10 Q13118 2/20 0.68
HRH3 Q9Y5N1 2/20 0.68

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
SCHEMBL14085606 0.86 SLC6A4 (0.75) SLC6A4SLC6A2
SCHEMBL14085621 0.86 SLC6A4 (0.75) SLC6A4SLC6A2
SCHEMBL5078702 0.86 SLC6A4 (0.75) SLC6A4SLC6A2CYP1A2CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL6268557 0.85 SLC6A2 (0.73) SLC6A4SLC6A2PMP22
Hydrochloric Acid SCHEMBL4848278 0.85 SLC6A2 (0.73) SLC6A4SLC6A2PMP22
Hydrochloric Acid SCHEMBL4851048 0.85 SLC6A2 (0.73) SLC6A4SLC6A2PMP22
Hydrochloric Acid SCHEMBL7771743 0.85 SLC6A4 (0.73) SLC6A4SLC6A2
SCHEMBL3967638 0.84 SLC6A4 (1.00) SLC6A4SLC6A2CYP1A2CYP3A4CYP2D6
SCHEMBL3359634 0.84 SLC6A4 (1.00) SLC6A4SLC6A2CYP1A2CYP3A4CYP2D6
SCHEMBL14085618 0.84 SLC6A2 (0.72) SLC6A4SLC6A2CYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2629615-B1 SLOW-RELEASE FORMULATIONS OF 5-HYDROXYTRYPTOPHAN AS AN ADJUNCT TO PRO-SEROTONERGIC THERAPIES UNIV DUKE (US) 2018-10-10 EP disclosed
US-20160374957-A1 SLOW-RELEASE FORMULATIONS OF 5-HYDROXYTRYPTOPHAN AS AN ADJUNCT TO PRO-SEROTONERGIC THERAPIES UNIV DUKE (US) 2016-12-29 US disclosed
US-9468627-B2 Slow-release formulations of 5-hydroxytryptophan as an adjunct to pro-serotonergic therapies DUKE UNIVERSITY (US) 2016-10-18 US disclosed
US-20130338192-A1 METHOD FOR AUGMENTING THE EFFECTS OF SEROTONIN REUPTAKE INHIBITORS DUKE UNIVERSITY (US) 2013-12-19 US disclosed
US-20130230577-A1 SLOW-RELEASE FORMULATIONS OF 5-HYDROXYTRYPTOPHAN AS AN ADJUNCT TO PRO-SEROTONERGIC THERAPIES DUKE UNIVERSITY (US) 2013-09-05 US disclosed
EP-2629615-A1 SLOW-RELEASE FORMULATIONS OF 5-HYDROXYTRYPTOPHAN AS AN ADJUNCT TO PRO-SEROTONERGIC THERAPIES Duke University (US) 2013-08-28 EP disclosed
WO-2012054815-A1 SLOW-RELEASE FORMULATIONS OF 5-HYDROXYTRYPTOPHAN AS AN ADJUNCT TO PRO-SEROTONERGIC THERAPIES DUKE UNIVERSITY (US) 2012-04-26 WO disclosed
US-20090192166-A1 METHOD FOR AUGMENTING THE EFFECTS OF SEROTONIN REUPTAKE INHIBITORS DUKE UNIVERSITY (US) 2009-07-30 US disclosed
US-7517908-B2 Method for augmenting the effects of serotonin reuptake inhibitors DUKE UNIVERSITY (US) 2009-04-14 US disclosed
EP-1746985-A2 METHOD FOR AUGMENTING THE EFFECTS OF SEROTONIN REUPTAKE INHIBITORS DUKE UNIVERSITY (US) 2007-01-31 EP disclosed
US-20060142375-A1 Method for augmenting the effects of serotonin reuptake inhibitors DUKE UNIVERSITY 2006-06-29 US disclosed
WO-2005112906-A2 METHOD FOR AUGMENTING THE EFFECTS OF SEROTONIN REUPTAKE INHIBITORS DUKE UNIVERSITY (US) 2005-12-01 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 (2 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-20130230577-A1 SLOW-RELEASE FORMULATIONS OF 5-HYDROXYTRYPTOPHAN AS AN ADJUNCT TO PRO-SEROTONERGIC THERAPIES TPH1, HTR5A, TPH2 SLC6A4 13/4885SLC6A2 25/4885CYP1A2 1610/4885
US-20160374957-A1 SLOW-RELEASE FORMULATIONS OF 5-HYDROXYTRYPTOPHAN AS AN ADJUNCT TO PRO-SEROTONERGIC THERAPIES TPH1, HTR5A, TPH2 SLC6A4 13/4885SLC6A2 25/4885CYP1A2 1536/4885

“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.