SCHEMBL11565474

SCHEMBL11565474

CC(=O)C(C)(Cl)Cc1cc(Cl)c(Cl)cc1Cl

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.33
NR1H4 Q96RI1 2/20 0.33
LMNA P02545 1/20 0.32
GGPS1 O95749 1/20 0.31
POLB P06746 1/20 0.30
ALDH1A1 P00352 2/20 0.30
KDM4E B2RXH2 1/20 0.30
HTT P42858 1/20 0.30
KCNJ6 P48051 1/20 0.30
KCNJ5 P48544 1/20 0.30
KCNJ3 P48549 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
SCHEMBL11566864 0.81 LMNA (0.39) EPHX2NR1H4LMNAPOLBALDH1A1
SCHEMBL11566872 0.78 RAB9A (0.46) ALDH1A1HTTKCNJ6KCNJ5KCNJ3
SCHEMBL11563425 0.73 LMNA (0.46) LMNAPOLBALDH1A1HTTKCNJ6
SCHEMBL5485596 0.71 MAPK1 (0.35) GGPS1
SCHEMBL15943530 0.68 RIPK1 (0.33) EPHX2NR1H4GGPS1
SCHEMBL14565894 0.67 GRIN2D (0.32)
SCHEMBL11563435 0.66 AKR1B1 (0.41) LMNAPOLBHTT
SCHEMBL11389658 0.66
SCHEMBL2943555 0.65 SMN1; SMN2 (0.47) LMNAALDH1A1
SCHEMBL28341702 0.65 NOTUM (0.43) LMNAPOLBALDH1A1KDM4EHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4145362-A DIAZOTIZATION OF ARYLAMINE IN PRESENCE OF ALKANOIC ACID, COPPER HALIDE CATALYST S.A. P R B EN NEERLANDAIS PRB N.V. (BE) 1979-03-20 US disclosed