SCHEMBL8356414

SCHEMBL8356414

COC(=O)c1cn(Cc2ccccc2)c2ccc(OC)cc12

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.70
ALDH1A1 P00352 3/20 0.70
PLA2G2A P14555 4/20 0.65
MTNR1A P48039 1/20 0.63
MTNR1B P49286 1/20 0.63
CHRM1 P11229 1/20 0.58
HTR6 P50406 1/20 0.57
CNR1 P21554 1/20 0.56
CNR2 P34972 1/20 0.56
PLA2G1B P04054 1/20 0.54
SERPINE1 P05121 1/20 0.53
NR4A2 P43354 1/20 0.52
KDM4E B2RXH2 1/20 0.52
HPGD P15428 1/20 0.52
TSHR P16473 1/20 0.52
RAB9A P51151 1/20 0.52
HSD17B10 Q99714 1/20 0.52

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
SCHEMBL8356932 0.90 LMNA (0.73) LMNAALDH1A1PLA2G2AMTNR1AMTNR1B
SCHEMBL8358799 0.86 NR4A2 (0.53) LMNAALDH1A1PLA2G2ASERPINE1NR4A2
SCHEMBL28853763 0.86 LMNA (0.71) LMNAALDH1A1PLA2G2AMTNR1AMTNR1B
SCHEMBL2430574 0.84 NR4A2 (0.72) LMNAALDH1A1CNR1CNR2NR4A2
SCHEMBL28511884 0.83 LMNA (0.61) LMNAALDH1A1PLA2G2AMTNR1AMTNR1B
SCHEMBL28508117 0.82 LMNA (0.62) LMNAALDH1A1PLA2G2AMTNR1AMTNR1B
SCHEMBL1548669 0.81 LMNA (0.94) LMNAALDH1A1CHRM1
SCHEMBL20769739 0.81 PLA2G2A (0.83) LMNAALDH1A1PLA2G2AMTNR1AMTNR1B
SCHEMBL28512821 0.80 LMNA (0.57) LMNAALDH1A1PLA2G2AMTNR1AMTNR1B
SCHEMBL5066775 0.80 NR4A2 (0.51) LMNAALDH1A1PLA2G2AMTNR1AMTNR1B

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
US-5877202-A Indole derivatives useful to treat estrogen-related neoplasms and disorders AVENTISUB II INC. 1999-03-02 US disclosed
EP-0746544-B1 NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS MERRELL PHARMA INC (US) 1998-09-09 EP disclosed
EP-0746544-A1 NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS MERRELL PHARMACEUTICALS INC. (US) 1996-12-11 EP disclosed
WO-1995022524-A1 NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS MERRELL PHARMACEUTICALS INC. (US) 1995-08-24 WO disclosed