SCHEMBL30782820

SCHEMBL30782820

CCCCCCCCCCCCCCC(O)C(O)CCCC

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.65
CYP2D6 P10635 2/20 0.60
LMNA P02545 2/20 0.60
GMNN O75496 1/20 0.60
POLB P06746 1/20 0.60
THPO P40225 1/20 0.60
MTOR P42345 1/20 0.60
BLM P54132 1/20 0.60
KDM4E B2RXH2 1/20 0.60
TP53 P04637 1/20 0.60
CYP1A2 P05177 1/20 0.60
CYP3A4 P08684 1/20 0.60
MAPT P10636 1/20 0.60
CETP P11597 1/20 0.60
HTT P42858 1/20 0.60
UBE2N P61088 1/20 0.60
DNM1 Q05193 2/20 0.52
GPR84 Q9NQS5 7/20 0.52
FFAR1 O14842 1/20 0.52
CA2 P00918 1/20 0.48

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
SCHEMBL7742185 1.00 SPHK1 (0.65) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL30787405 1.00 SPHK1 (0.65) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL30787255 1.00 SPHK1 (0.65) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL28690288 1.00 SPHK1 (0.65) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL14666494 1.00 SPHK1 (0.65) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL30787346 1.00 SPHK1 (0.65) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL22804874 0.97 SPHK1 (0.68) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL22804904 0.97 SPHK1 (0.68) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL22804811 0.97 SPHK1 (0.68) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL22804890 0.97 SPHK1 (0.68) SPHK1CYP2D6LMNAGMNNPOLB

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
WO-2024073476-A2 COMPOSITIONS AND METHODS FOR TREATING CANCER BY REDUCING THE EXPRESSION AND/OR ACTIVITY OF PLA2G10 YALE UNIVERSITY (US) 2024-04-04 WO claimed
EP-4554379-A1 USE OF AN ALKANEDIOL AS HERBICIDE Apeo - Agronomical Plant Extracts & Essential Oils (BE) 2025-05-21 EP disclosed
WO-2024073476-A2 COMPOSITIONS AND METHODS FOR TREATING CANCER BY REDUCING THE EXPRESSION AND/OR ACTIVITY OF PLA2G10 YALE UNIVERSITY (US) 2024-04-04 WO disclosed
WO-2024013148-A1 USE OF AN ALKANEDIOL AS HERBICIDE APEO – AGRONOMICAL PLANT EXTRACTS & ESSENTIAL OILS (BE) 2024-01-18 WO disclosed