SCHEMBL9762126

SCHEMBL9762126

CCCCCCCCCCCC(=O)N[C@H](CCC(=O)OCC(CCCCCCCC)CCCCCCCC)C(=O)OCC(CCCCCCCC)CCCCCCCC

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.64
POLB P06746 1/20 0.58
CYP3A4 P08684 1/20 0.51
TSHR P16473 1/20 0.51
ATM Q13315 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
NOD1 Q9Y239 6/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
MAPT P10636 1/20 0.46
MEN1 O00255 2/20 0.45
FAAH O00519 1/20 0.45
MAPK1 P28482 1/20 0.45
PLA2G2C Q5R387 1/20 0.45
DNM1 Q05193 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
KDM4E B2RXH2 1/20 0.43
DUSP3 P51452 1/20 0.43

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
SCHEMBL9762120 1.00 KMT2A (0.64) KMT2APOLBCYP3A4TSHRATM
SCHEMBL29129967 1.00 KMT2A (0.64) KMT2APOLBCYP3A4TSHRATM
SCHEMBL155007 1.00 KMT2A (0.64) KMT2APOLBCYP3A4TSHRATM
SCHEMBL155009 1.00 KMT2A (0.64) KMT2APOLBCYP3A4TSHRATM
Adipic Acid SCHEMBL29008920 0.95 KMT2A (0.59) KMT2APOLBCYP3A4TSHRATM
SCHEMBL3773048 0.92 TSHR (0.63) KMT2APOLBCYP3A4TSHRATM
SCHEMBL3773052 0.92 TSHR (0.63) KMT2APOLBCYP3A4TSHRATM
SCHEMBL9762122 0.91 NOD1 (0.64) KMT2APOLBCYP3A4TSHRATM
SCHEMBL1349261 0.91 NOD1 (0.64) KMT2APOLBCYP3A4TSHRATM
SCHEMBL155008 0.91 NOD1 (0.64) KMT2APOLBCYP3A4TSHRATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3368592-B1 COSMETIC COMPOSITION, COSMETIC, AND EXTERNAL PREPARATION FOR SKIN DOW TORAY CO LTD (JP) 2025-12-03 EP disclosed
US-5053222-A Antidandruff agents SHISEIDO COMPANY LTD. (JP) 1991-10-01 US disclosed