SCHEMBL28107647

SCHEMBL28107647

CCCCC=C(C)C(=O)OCCCCCCCCC

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.58
NAAA Q02083 1/20 0.48
HCAR2 Q8TDS4 2/20 0.46
RAD52 P43351 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
EPHX1 P07099 1/20 0.46
FAAH O00519 2/20 0.45
ALDH1A1 P00352 2/20 0.44
CES2 O00748 1/20 0.43
EP300 Q09472 1/20 0.43
LMNA P02545 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HTT P42858 1/20 0.42
ATM Q13315 1/20 0.41

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
SCHEMBL27934279 1.00 TSHR (0.58) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL27932227 1.00 TSHR (0.58) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL28214986 1.00 TSHR (0.58) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL28107306 1.00 TSHR (0.58) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL11146407 0.98 TSHR (0.55) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL9724670 0.96 TSHR (0.58) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL8752883 0.96 TSHR (0.58) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL16936123 0.96 TSHR (0.58) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL5424452 0.96 TSHR (0.58) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL1133210 0.96 TSHR (0.58) TSHRNAAAHCAR2RAD52NPSR1

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
CN-116981758-A Thermally responsive brush polymers having a copolymer backbone and copolymer arms 英菲诺姆国际有限公司 2023-10-31 CN disclosed
CN-106119443-B The grease proofing antifouling care agent of aerosol type surface waterproofing 崔晓雪 2018-08-21 CN disclosed
CN-106119443-A The grease proofing antifouling nursing agent of aerosol type surface waterproofing 崔晓雪 2016-11-16 CN disclosed