SCHEMBL8680879

SCHEMBL8680879

C=C(C)C(=O)OCCOC1CCCO1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
THRB P10828 1/20 0.44
TSHR P16473 3/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
POLB P06746 2/20 0.33
LMNA P02545 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
EPHX1 P07099 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL9480448 0.95 ALDH1A1 (0.44) ALDH1A1THRBTSHRKMT2AMEN1
SCHEMBL28801039 0.89 HTR2A (0.40) ALDH1A1THRBTSHRKMT2AMEN1
SCHEMBL25475947 0.86 ALDH1A1 (0.46) ALDH1A1THRBTSHRKMT2AMEN1
SCHEMBL15498956 0.84 KMT2A (0.42) ALDH1A1TSHRKMT2AMEN1KDM4C
SCHEMBL20608690 0.83 MEN1 (0.45) KMT2AMEN1KDM4CPOLBLMNA
SCHEMBL9615822 0.82 ALDH1A1 (0.56) ALDH1A1THRBTSHRCA1CA2
SCHEMBL25475949 0.82 ALDH1A1 (0.45) ALDH1A1THRBTSHRKMT2AMEN1
SCHEMBL29686616 0.81 ALDH1A1 (0.47) ALDH1A1THRBTSHRCA1CA2
SCHEMBL14437386 0.80 MEN1 (0.41) ALDH1A1THRBTSHRKMT2AMEN1
SCHEMBL31066746 0.79 TSHR (0.41) ALDH1A1THRBTSHRKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240240047-A1 BIOMEDICAL DEVICES HAVING A SURFACE COATING JPMORGAN CHASE BANK, N.A., AS SUCCESSOR AGENT 2024-07-18 US disclosed
US-20240240047-A1 BIOMEDICAL DEVICES HAVING A SURFACE COATING JPMORGAN CHASE BANK, N.A., AS SUCCESSOR AGENT 2024-07-18 US disclosed
WO-2023161325-A1 OPHTHALMIC DEVICES BAUSCH + LOMB IRELAND LIMITED (IE) 2023-08-31 WO disclosed
US-20230266505-A1 OPHTHALMIC DEVICES JPMORGAN CHASE BANK, N.A., AS SUCCESSOR AGENT 2023-08-24 US disclosed
US-20230266505-A1 OPHTHALMIC DEVICES JPMORGAN CHASE BANK, N.A., AS SUCCESSOR AGENT 2023-08-24 US disclosed
CN-114829736-A Downhole ultrasonic actuator system for mitigating loss 沙特阿拉伯石油公司 2022-07-29 CN disclosed
WO-2022105660-A1 CYCLOALKANE-BASED ULTRAVIOLET CURING PACKAGING INK, USE METHOD THEREFOR AND USE THEREOF 西安思摩威新材料有限公司 2022-05-27 WO disclosed
US-5840806-A COMPOSITION COMPRISING RESIN FORMED BY CONDENSATION OF POLYSILOXANE WITH POLYMER HAVING HYDROLYZABLE SILYL GROUP AND ADDITIONAL FUNCTIONAL GROUP, COMPOUND CAPABLE OF REACTING WITH SAID GROUP DAINIPPON INK AND CHEMICALS, INC. (JP) 1998-11-24 US disclosed