SCHEMBL7582847

SCHEMBL7582847

CNC(=O)c1[c]cc(Br)cc1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 1/20 0.41
USP2 O75604 1/20 0.37
HDAC8 Q9BY41 2/20 0.34
HDAC6 Q9UBN7 2/20 0.34
HDAC2 Q92769 1/20 0.34
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.32
BRD4 O60885 1/20 0.30
BRD2 P25440 1/20 0.30
BRD3 Q15059 1/20 0.30
BRDT Q58F21 1/20 0.30
TUBB4A P04350 1/20 0.30
TUBB P07437 1/20 0.30
TUBA3C P0DPH7 1/20 0.30
TUBA1B P68363 1/20 0.30
TUBA4A P68366 1/20 0.30
TUBB4B P68371 1/20 0.30
TUBB3 Q13509 1/20 0.30
TUBB2A Q13885 1/20 0.30
TUBB8 Q3ZCM7 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
SCHEMBL7585720 0.79 CYP3A4 (0.36)
SCHEMBL7574870 0.70 ALDH1A1 (0.39) CREBBPUSP2HDAC8HDAC6HDAC2
SCHEMBL9024081 0.68 LMNA (0.41) KMT2ALMNA
SCHEMBL7577514 0.68 ALDH1A1 (0.37) KMT2ALMNA
SCHEMBL7579409 0.68 HDAC8 (0.39) CREBBPHDAC8HDAC6HDAC2KMT2A
SCHEMBL26613950 0.64 DGAT1 (0.35)
SCHEMBL26613877 0.64 ALDH1A1 (0.33)
SCHEMBL12476437 0.63 HDAC8 (0.55) CREBBPUSP2HDAC8HDAC6HDAC2
SCHEMBL1006484 0.63 HDAC8 (0.52) CREBBPUSP2HDAC8HDAC6HDAC2
SCHEMBL27417512 0.63 NPC1 (0.41) CREBBPUSP2HDAC8HDAC6HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882730-B1 PHOSPHONIC ACID DIESTER DERIVATIVES OTSUKA PHARMA CO LTD (JP) 2002-10-02 EP disclosed
US-5985858-A TREATING AND PREVENTING HYPERLIPIDEMIA, DIABETES AND CATARACT, OR AS AN ANTITUMOR AGENT OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1999-11-16 US disclosed
EP-0882730-A1 PHOSPHONIC ACID DIESTER DERIVATIVES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1998-12-09 EP disclosed