SCHEMBL7850487

SCHEMBL7850487

Cn1c(C(=O)O)c(-c2ccccc2)c2cccnc2c1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 14/20 0.59
PADI4 Q9UM07 1/20 0.44
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 1/20 0.41
KDM6B O15054 1/20 0.41
KDM6A O15550 1/20 0.41
TET3 O43151 1/20 0.41
KDM4A O75164 1/20 0.41
KDM4B O94953 1/20 0.41
KDM5C P41229 1/20 0.41
KDM4D Q6B0I6 1/20 0.41
TET2 Q6N021 1/20 0.41
ALKBH5 Q6P6C2 1/20 0.41
TET1 Q8NFU7 1/20 0.41
FTO Q9C0B1 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
KDM2A Q9Y2K7 1/20 0.41

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
SCHEMBL7852137 0.91 TACR1 (0.56) TACR1SMN1; SMN2KDM4E
SCHEMBL7849465 0.90 TACR1 (0.63) TACR1GRIA2GRIA4
Hydrochloric Acid SCHEMBL7852820 0.90 TACR1 (0.66) TACR1GRIA2GRIA4
SCHEMBL7854807 0.89 TACR1 (0.48) TACR1PADI4LMNAKMT2ASMN1; SMN2
SCHEMBL7849658 0.88 TACR1 (0.54) TACR1KMT2AKDM4EGRIA2GRIA4
Hydrochloric Acid SCHEMBL7852917 0.87 TACR1 (0.52) TACR1KMT2AGRIA2GRIA4
SCHEMBL7854819 0.82 TACR1 (0.55) TACR1LMNAKMT2AEGLN1L3MBTL1
SCHEMBL8784770 0.81 TACR1 (0.55) TACR1LMNAKMT2ASMN1; SMN2GRIA2
SCHEMBL7850548 0.80 TACR1 (0.63) TACR1SMN1; SMN2KDM4E
SCHEMBL7841672 0.80 TACR1 (0.52) TACR1GRIA2GRIA4

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-0652218-B1 Heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-07-11 EP disclosed
US-5585385-A USEFUL IN TREATING DISORDERS OF MICTURITION; ADMINISTERING TO INHIBIT PLASMA EXTRAVASATION TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-12-17 US disclosed
EP-0652218-A1 Heterocyclic compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1995-05-10 EP disclosed