SCHEMBL7703337

SCHEMBL7703337

CC(=O)Nc1ccc(-c2oc(-c3ccc(C(C)(C)C)cc3)nc2C(=O)Nc2cccc3ccccc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.49
KDM4E B2RXH2 2/20 0.49
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
IKBKB O14920 2/20 0.44
TRPV1 Q8NER1 1/20 0.43
NLRP3 Q96P20 1/20 0.43
POLB P06746 1/20 0.43
TNIK Q9UKE5 1/20 0.42
CCR4 P51679 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
MAPK14 Q16539 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
SCHEMBL7693982 0.91 NLRP3 (0.44) KDM4ERAB9ANPC1IKBKBNLRP3
SCHEMBL7694083 0.91 KDM4E (0.59) GAAKDM4ERAB9ANPC1POLB
SCHEMBL7695211 0.88 KDM4E (0.53) GAAKDM4ERAB9ANPC1IKBKB
SCHEMBL7697947 0.87 KMT2A (0.47) GAAKDM4ERAB9ANPC1IKBKB
SCHEMBL7703553 0.87 KDM4E (0.49) GAAKDM4ERAB9ANPC1IKBKB
SCHEMBL7703333 0.86 KDM4E (0.64) GAAKDM4ERAB9ANPC1IKBKB
SCHEMBL7699576 0.86 KDM4E (0.48) GAAKDM4ERAB9ANPC1IKBKB
SCHEMBL7703211 0.84 KDM4E (0.49) GAAKDM4ERAB9ANPC1IKBKB
SCHEMBL7693950 0.82 IKBKB (0.52) GAAKDM4EIKBKBTRPV1TP53
SCHEMBL7699894 0.81 IKBKB (0.54) GAAKDM4ERAB9ANPC1IKBKB

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
WO-2002064558-A2 OXAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS CYTOKINE INHIBITORS SANKYO COMPANY, LIMITED (JP) 2002-08-22 WO claimed
WO-2002064558-A2 OXAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS CYTOKINE INHIBITORS SANKYO COMPANY, LIMITED (JP) 2002-08-22 WO disclosed