SCHEMBL11630337

SCHEMBL11630337

CCc1cc(Cc2ccccc2)cnc1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.45
PTPN2 P17706 1/20 0.45
PTPN6 P29350 1/20 0.45
LMNA P02545 1/20 0.45
HNF4A P41235 1/20 0.41
HCAR2 Q8TDS4 1/20 0.39
RNASEH1 O60930 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP1A2 P05177 1/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
EGLN2 Q96KS0 1/20 0.38
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38
TSHR P16473 1/20 0.38
PLA2G10 O15496 1/20 0.38

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
SCHEMBL11633695 0.88 ESR1 (0.41) PTPN1PTPN2PTPN6LMNAHNF4A
SCHEMBL11630841 0.83 RNASEH1 (0.42) PTPN1PTPN2PTPN6LMNAHNF4A
SCHEMBL13850877 0.81 HNF4A (0.54) PTPN1PTPN2PTPN6HNF4AKDM4E
SCHEMBL16019088 0.79 PLA2G10 (0.42) PTPN1PTPN2PTPN6LMNAHNF4A
SCHEMBL480096 0.79 GABRP (0.40) LMNAHCAR2KDM4ECYP1A2MAPT
SCHEMBL13851064 0.77 KDM4E (0.48) LMNAKDM4ECYP1A2MAPTALDH1A1
SCHEMBL924382 0.77 HNF4A (0.50) PTPN1PTPN2PTPN6LMNAHNF4A
SCHEMBL13851063 0.75 KDM4E (0.46) PTPN1PTPN2PTPN6HNF4AKDM4E
SCHEMBL12358956 0.74 LMNA (0.47) LMNAHNF4AALDH1A1HPGDHTT
SCHEMBL14065327 0.74 KDM4E (0.47) LMNAKDM4EMAPTALDH1A1HPGD

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-4109000-A HYPOTENSIVES NIPPON SHINYAKU CO., LTD. (JP) 1978-08-22 US claimed