SCHEMBL23929281

SCHEMBL23929281

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCNCCCC=O

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.68
ADH1B P00325 3/20 0.62
ADH1A P07327 3/20 0.62
ADH7 P40394 3/20 0.62
ADH1C P00326 2/20 0.62
EPHX1 P07099 2/20 0.62
ADH4 P08319 1/20 0.62
ALDH1A1 P00352 2/20 0.62
FAAH O00519 2/20 0.60
TRPV1 Q8NER1 2/20 0.60
S1PR2 O95136 5/20 0.50
S1PR4 O95977 5/20 0.50
S1PR1 P21453 5/20 0.50
S1PR3 Q99500 5/20 0.50
S1PR5 Q9H228 1/20 0.50
PPARA Q07869 1/20 0.46

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
SCHEMBL25954739 1.00 TSHR (0.68) TSHRADH1BADH1AADH7ADH1C
SCHEMBL27789560 1.00 TSHR (0.68) TSHRADH1BADH1AADH7ADH1C
SCHEMBL17779397 1.00 TSHR (0.68) TSHRADH1BADH1AADH7ADH1C
SCHEMBL25200621 1.00 TSHR (0.68) TSHRADH1BADH1AADH7ADH1C
SCHEMBL28736426 1.00 TSHR (0.68) TSHRADH1BADH1AADH7ADH1C
SCHEMBL25274699 0.95 TSHR (0.76) TSHRADH1BADH1AADH7ADH1C
SCHEMBL25093179 0.95 TSHR (0.76) TSHRADH1BADH1AADH7ADH1C
SCHEMBL3022776 0.95 TSHR (0.76) TSHRADH1BADH1AADH7ADH1C
SCHEMBL25093248 0.95 TSHR (0.76) TSHRADH1BADH1AADH7ADH1C
SCHEMBL3031672 0.93 TSHR (0.71) TSHRADH1BADH1AADH7ADH1C

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
EP-4168009-A1 CONJUGATES OF A CELL-BINDING MOLECULE WITH CAMPTOTHECIN ANALOGS Hangzhou DAC Biotech Co., Ltd. (CN) 2023-04-26 EP disclosed
WO-2022078524-A4 SPECIFIC CONJUGATION OF AN ANTIBODY HANGZHOU DAC BIOTECH CO., LTD. (CN) 2022-12-08 WO disclosed
WO-2022078524-A2 SPECIFIC CONJUGATION OF AN ANTIBODY HANGZHOU DAC BIOTECH CO., LTD. (CN) 2022-04-21 WO disclosed
WO-2021212638-A1 CONJUGATES OF A CELL-BINDING MOLECULE WITH CAMPTOTHECIN ANALOGS HANGZHOU DAC BIOTECH CO., LTD. (CN) 2021-10-28 WO disclosed