SCHEMBL18625310

SCHEMBL18625310

CC(=O)Nc1ccc(C(C)=O)c(OC(=O)c2cc(F)c(N(C)Cc3ccccc3)c(F)c2)c1C

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 9/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ KMT2A Q03164 4/20 0.37
▸ LMNA P02545 3/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ GAA P10253 1/20 0.37
▸ STAT1 P42224 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ ATM Q13315 1/20 0.36
▸ MAPT P10636 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ NR3C1 P04150 1/20 0.35
▸ F10 P00742 1/20 0.34

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
SCHEMBL31191034 0.72 CRHBP (0.39) BRD4ALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL31290998 0.72 CRHBP (0.39) BRD4ALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL16875663 0.70 ALDH1A1 (0.56) ALDH1A1KMT2AKDM4ERAB9AMEN1
SCHEMBL15550514 0.68 ALDH1A1 (0.53) ALDH1A1KMT2ASMN1; SMN2KDM4ERAB9A
SCHEMBL11522294 0.64 BRD4 (0.59) BRD4ALDH1A1KMT2ALMNARAB9A
SCHEMBL16875669 0.63 MDM2 (0.42) ALDH1A1KMT2ASMN1; SMN2RAB9AMEN1
SCHEMBL6108137 0.61 SMN1; SMN2 (0.44) BRD4ALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL11622461 0.60 KMT2A (0.48) BRD4ALDH1A1KMT2AKDM4EMEN1
SCHEMBL31587599 0.60 LMNA (0.42) KMT2ALMNAMEN1NR3C1
SCHEMBL25359757 0.60 CYP19A1 (0.58) BRD4KMT2ASMN1; SMN2MEN1MAPT

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-9593125-B2 Heterocyclic flavone derivatives, compositions, and methods related thereto EMORY UNIVERSITY (US) 2017-03-14 — — US disclosed
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