SCHEMBL20128967

SCHEMBL20128967

Brc1ccc(OCCCCCOCCCCCOC2CNC2)nc1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.35
HTR6 P50406 2/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
LSS P48449 2/20 0.33
DGAT1 O75907 1/20 0.32
REN P00797 1/20 0.32
KDM4E B2RXH2 1/20 0.30
KDM1A O60341 1/20 0.30
EP300 Q09472 1/20 0.30
GABRA5 P31644 1/20 0.30

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
SCHEMBL20128963 0.78 REN (0.38) SLC6A4RENGABRA5
SCHEMBL20128972 0.76 CYP3A4 (0.48) LSSKDM4EGABRA5
SCHEMBL23720520 0.75 LSS (0.41) LSSKDM4EGABRA5
SCHEMBL9085482 0.75 NPC1 (0.38) LSSDGAT1KDM4EKDM1AEP300
SCHEMBL30314525 0.74 SLC6A4 (0.43) SLC6A4HTR6HTR2CHTR2BDGAT1
SCHEMBL10078051 0.74 SLC6A4 (0.43) SLC6A4HTR6HTR2CHTR2BDGAT1
SCHEMBL20128968 0.73 DGAT1 (0.46) DGAT1GABRA5
SCHEMBL23720317 0.73 LSS (0.39) LSSKDM4EGABRA5
Hydrochloric Acid SCHEMBL31347800 0.72 SLC6A4 (0.42) SLC6A4HTR6HTR2CHTR2BDGAT1
Hydrochloric Acid SCHEMBL517567 0.72 SLC6A4 (0.42) SLC6A4HTR6HTR2CHTR2BDGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912699-B2 Tau-protein targeting compounds and associated ARVINAS OPERATIONS, INC. (US) 2024-02-27 US disclosed
WO-2021011913-A1 TAU-PROTEIN TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2021-01-21 WO disclosed
WO-2018102067-A2 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE Arvinas, Inc. (US) 2018-06-07 WO disclosed
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2018-05-10 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 (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-11912699-B2 Tau-protein targeting compounds and associated MAPT, VHL, CRBN SLC6A4 3755/4885HTR6 2908/4885HTR2C 3471/4885
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE CRBN, VHL, UBQLN2 SLC6A4 4312/4885HTR6 3278/4885HTR2C 3135/4885

“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.