SCHEMBL5481862

SCHEMBL5481862

CCC[C@@H](CCNC)Oc1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 13/20 0.56
SLC6A2 P23975 4/20 0.46
CYP2D6 P10635 4/20 0.46
NOS2 P35228 3/20 0.46
TAAR1 Q96RJ0 1/20 0.41
P2RX3 P56373 1/20 0.37
NPC1 O15118 2/20 0.37
CYP2C19 P33261 2/20 0.37
MTOR P42345 2/20 0.37
RAB9A P51151 2/20 0.37
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 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
SCHEMBL5481863 1.00 SLC6A4 (0.56) SLC6A4SLC6A2CYP2D6NOS2TAAR1
SCHEMBL5481857 1.00 SLC6A4 (0.56) SLC6A4SLC6A2CYP2D6NOS2TAAR1
Hydrochloric Acid SCHEMBL5474763 0.98 SLC6A4 (0.55) SLC6A4SLC6A2CYP2D6NOS2TAAR1
Hydrochloric Acid SCHEMBL5474768 0.98 SLC6A4 (0.55) SLC6A4SLC6A2CYP2D6NOS2TAAR1
Hydrochloric Acid SCHEMBL5474756 0.98 SLC6A4 (0.55) SLC6A4SLC6A2CYP2D6NOS2TAAR1
SCHEMBL10266604 0.89 SLC6A4 (0.57) SLC6A4SLC6A2CYP2D6NOS2TAAR1
SCHEMBL5470667 0.84 SLC6A4 (0.43) SLC6A4SLC6A2CYP2D6NOS2KMT2A
SCHEMBL5470666 0.84 SLC6A4 (0.43) SLC6A4SLC6A2CYP2D6NOS2KMT2A
SCHEMBL5470668 0.84 SLC6A4 (0.43) SLC6A4SLC6A2CYP2D6NOS2KMT2A
SCHEMBL5475463 0.83 SLC6A4 (0.59) SLC6A4SLC6A2CYP2D6NOS2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070072859-A1 Pharmaceutical compounds ELI LILLY AND COMPANY (US) 2007-03-29 US claimed
EP-1725518-A1 PHARMACEUTICAL COMPOUNDS ELI LILLY AND COMPANY (US) 2006-11-29 EP claimed
WO-2005092835-A1 PHARMACEUTICAL COMPOUNDS ELI LILLY AND COMPANY (US) 2005-10-06 WO claimed

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-20070072859-A1 Pharmaceutical compounds ADRB3, HTR3C, SLC6A2 SLC6A4 15/4885SLC6A2 3/4885CYP2D6 255/4885

“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.