SCHEMBL7414744

SCHEMBL7414744

CCCCc1[nH]c2c(C(=O)O)cccc2c1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 2/20 0.44
GFER P55789 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
PIM1 P11309 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
OXER1 Q8TDS5 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
FGFR1 P11362 1/20 0.41
FLT1 P17948 1/20 0.41
KDR P35968 1/20 0.41
BID P55957 3/20 0.40
MCL1 Q07820 3/20 0.40
BCL2L1 Q07817 2/20 0.40
BAK1 Q16611 2/20 0.40
KAT8 Q9H7Z6 2/20 0.40
AGTR1 P30556 2/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40

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
SCHEMBL7410235 0.81 LMNA (0.44) KDM4EMAPTPIM1OXER1HTT
SCHEMBL8782766 0.78 OXER1 (0.66) KDM4EMAPTTDP1OXER1TSHR
SCHEMBL12667343 0.77 KDM4E (0.47) PBRM1GFERKDM4EMAPTPIM1
SCHEMBL7411523 0.77 OXER1 (0.44) KDM4EMAPTPIM1OXER1HTT
SCHEMBL7070059 0.74 OXER1 (0.72) KDM4EMAPTTDP1OXER1TSHR
SCHEMBL6650822 0.72 BID (0.45) KDM4EMAPTBIDMCL1BCL2L1
SCHEMBL7410219 0.72 LMNA (0.49) KDM4EMAPTPIM1HTTALOX5
SCHEMBL409185 0.72 BID (0.62) KDM4EMAPTBIDMCL1BCL2L1
Benzene SCHEMBL9187610 0.72 BID (0.62) KDM4EMAPTBIDMCL1BCL2L1
SCHEMBL7410285 0.72 GAA (0.50) KDM4EMAPTHTTSMN1; SMN2MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0640080-A1 SUBSTITUTED INDOLES AND AZAINDOLES AS ANGIOTENSIN II ANTAGONISTS. SYNTEX INC (US) 1995-03-01 EP disclosed
US-5380739-A Angiotensin II antagonists SYNTEX (U.S.A.) INC. (US) 1995-01-10 US disclosed
WO-1993023391-A1 SUBSTITUTED INDOLES AND AZAINDOLES AS ANGIOTENSIN II ANTAGONISTS SYNTEX (U.S.A.) INC. (US) 1993-11-25 WO disclosed
US-5212195-A Substituted indole antagonists derivatives which are angiotensin II SYNTEX (U.S.A.) INC. (US) 1993-05-18 US disclosed