SCHEMBL16115254

SCHEMBL16115254

CCC1(CC(OC(=O)c2cccc(C(=O)O)c2)C2(CC)COC2)COC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 4/20 0.35
NPC1 O15118 4/20 0.35
RAB9A P51151 4/20 0.35
TP53 P04637 2/20 0.35
PKM P14618 2/20 0.35
NFKB1 P19838 2/20 0.35
NFKB2 Q00653 2/20 0.35
RELA Q04206 2/20 0.35
MRGPRX4 Q96LA9 2/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
CREBBP Q92793 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
POLB P06746 2/20 0.33
CYP2C9 P11712 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NR1H4 Q96RI1 1/20 0.33

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
SCHEMBL131960 0.84 KMT2A (0.42) KMT2ASMN1; SMN2NPC1RAB9ATP53
SCHEMBL27942852 0.78 TSHR (0.51) KMT2AMEN1TSHRL3MBTL1POLB
SCHEMBL9999589 0.72 TSHR (0.55) KMT2AMEN1TSHRSMN1; SMN2L3MBTL1
SCHEMBL132923 0.71 MAPT (0.42) KMT2ATSHRSMN1; SMN2NPC1RAB9A
SCHEMBL7181546 0.69 PRKCA (0.48) KMT2ASMN1; SMN2NPC1RAB9ATP53
Benzoic Acid SCHEMBL28849334 0.68 KMT2A (0.50) KMT2AMEN1TSHRMAPTPOLB
SCHEMBL27980364 0.68 CYP2C9 (0.39) KMT2ANPC1RAB9AL3MBTL1CYP2C9
SCHEMBL2289273 0.68 CA12 (0.39) KMT2AMEN1TSHRSMN1; SMN2NPC1
SCHEMBL9989638 0.68 KMT2A (0.46) KMT2ASMN1; SMN2NPC1RAB9ATP53
SCHEMBL3711959 0.68 KMT2A (0.46) KMT2ASMN1; SMN2NPC1RAB9ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025033020-A1 THERMALLY CONDUCTIVE COMPOSITION, METHOD FOR PRODUCING LAMINATE, AND LAMINATE デクセリアルズ株式会社 2025-02-13 WO disclosed
US-20240384147-A1 THERMALLY CONDUCTIVE COMPOSITION AND THERMALLY CONDUCTIVE SHEET DEXERIALS CORPORATION (JP) 2024-11-21 US disclosed
WO-2024053494-A1 (METH)ACRYLIC GROUP-CONTAINING POLYCARBOXYLIC ACID COMPOUND, THERMALLY CONDUCTIVE COMPOSITION, AND THERMALLY CONDUCTIVE SHEET デクセリアルズ株式会社 2024-03-14 WO disclosed
WO-2023182046-A1 ESTER COMPOUND, METHOD FOR PRODUCING SAME, THERMALLY CONDUCTIVE COMPOSITION AND THERMALLY CONDUCTIVE SHEET デクセリアルズ株式会社 2023-09-28 WO disclosed
WO-2023037862-A1 THERMALLY CONDUCTIVE COMPOSITION AND THERMALLY CONDUCTIVE SHEET デクセリアルズ株式会社 2023-03-16 WO disclosed
WO-2014158015-A1 RADIATION-CURABLE LIQUID RESIN COMPOSITION FOR OPTICAL THREE-DIMENSIONAL SHAPING, AND OPTICALLY SHAPED ARTICLE OBTAINED BY PHOTO-CURING THE SAME DSM IP ASSETS B.V. (NL) 2014-10-02 WO disclosed