SCHEMBL7268995

SCHEMBL7268995

O=C(O)c1cc(Cl)cc2c1OCCN2Cc1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 1/20 0.44
TSHR P16473 1/20 0.41
F10 P00742 1/20 0.41
KLKB1 P03952 1/20 0.41
DRD2 P14416 3/20 0.39
HDAC1 Q13547 3/20 0.39
HDAC6 Q9UBN7 3/20 0.39
ERCC1 P07992 1/20 0.39
ERCC4 Q92889 1/20 0.39
DRD4 P21917 1/20 0.38
MYC P01106 1/20 0.38
AKR1C3 P42330 1/20 0.38
NAAA Q02083 1/20 0.37
HDAC8 Q9BY41 2/20 0.37
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC10 Q969S8 1/20 0.37
HDAC11 Q96DB2 1/20 0.37

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
SCHEMBL7278170 0.93 DRD2 (0.46) SLC5A2TSHRDRD2
SCHEMBL7270723 0.92 GAA (0.40) SLC5A2TSHRDRD2MAPT
SCHEMBL7268755 0.89 MAPT (0.43) HDAC1HDAC6MAPT
SCHEMBL7271086 0.88 MAPT (0.44) TSHRDRD2NAAAKDM4EMAPT
SCHEMBL7278312 0.83 CYP1A2 (0.45) DRD2MAPT
SCHEMBL7269453 0.83 DRD2 (0.41) DRD2MYCAKR1C3MAPT
SCHEMBL7270656 0.82 DRD2 (0.52) SLC5A2TSHRDRD2NAAAMAPT
SCHEMBL7275959 0.81 DRD2 (0.38) DRD2MYC
SCHEMBL7269017 0.79 DRD2 (0.50) DRD2
SCHEMBL7274861 0.76 DRD2 (0.51) DRD2MYCAKR1C3

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-0407137-B1 Benzazine compounds and pharmaceutical uses thereof YOSHITOMI PHARMACEUTICAL (JP) 1996-05-01 EP disclosed
US-5185333-A Dopamine D2 receptor blocking agents YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1993-02-09 US disclosed
EP-0407137-A2 Benzazine compounds and pharmaceutical uses thereof YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-01-09 EP disclosed