SCHEMBL27332191

SCHEMBL27332191

CC1(C)OB(c2cccc(NC(=O)NCCCCl)c2)OC1(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.47
EPHX2 P34913 4/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HTT P42858 2/20 0.43
PDGFRB P09619 1/20 0.43
KDR P35968 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 1/20 0.42
LPL P06858 1/20 0.41
LIPG Q9Y5X9 1/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
MARS1 P56192 1/20 0.40
PKM P14618 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL16581991 0.86 PDGFRB (0.44) EPHX1KMT2AMEN1ALDH1A1PDGFRB
SCHEMBL3323121 0.86 MAPT (0.44) EPHX1KMT2AMEN1ALDH1A1HTT
SCHEMBL3322268 0.84 LPL (0.45) EPHX1ALDH1A1HTTPDGFRBKDR
SCHEMBL3321460 0.83 PRMT5 (0.46) EPHX1EPHX2KMT2AMEN1ALDH1A1
SCHEMBL18343188 0.83 ALDH1A1 (0.47) ALDH1A1HTTPDGFRBKDRLMNA
SCHEMBL14573269 0.81 SMN1; SMN2 (0.58) EPHX2PDGFRBKDRLMNATP53
SCHEMBL3319977 0.80 PRMT5 (0.48) EPHX2ALDH1A1PDGFRBKDRLMNA
SCHEMBL3321327 0.80 PDGFRB (0.41) KMT2AALDH1A1HTTPDGFRBKDR
SCHEMBL73204 0.80 L3MBTL1 (0.50) PDGFRBKDRCA1CA2CA9
SCHEMBL556699 0.80 PDGFRB (0.46) KMT2AMEN1ALDH1A1HTTPDGFRB

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
EP-4540247-A1 MULTI-KINASE INHIBITORS, COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME BIOFRONT LTD (KY) 2025-04-23 EP disclosed
WO-2023246491-A1 MULTI-KINASE INHIBITORS, COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME BIOFRONT LTD (KY) 2023-12-28 WO disclosed
WO-2023245329-A1 MULTI-KINASE INHIBITORS, COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME BIOFRONT LTD (KY) 2023-12-28 WO disclosed
WO-2023245329-A1 MULTI-KINASE INHIBITORS, COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME BIOFRONT LTD (KY) 2023-12-28 WO disclosed