SCHEMBL9828997

SCHEMBL9828997

O=C(c1ccc(O)cc1Cc1ccc(Cl)cc1)c1ccc(O)cc1Cc1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.60
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
NPSR1 Q6W5P4 1/20 0.43
LMNA P02545 2/20 0.43
HTT P42858 2/20 0.43
MAPK1 P28482 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MAOA P21397 2/20 0.42
MAOB P27338 2/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
HSP90AA1 P07900 1/20 0.42
POLA1 P09884 1/20 0.42
PIK3CA P42336 2/20 0.41
CYP3A4 P08684 2/20 0.41
HPGD P15428 2/20 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
SCHEMBL3442800 0.89 MEN1 (0.58) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL10968990 0.83 LMNA (0.54) MAPTMEN1KMT2ALMNAHTT
SCHEMBL7854884 0.83 MAPT (0.54) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL417015 0.83 ALOX5 (0.58) MEN1KMT2A
SCHEMBL10574439 0.79 L3MBTL1 (0.59) MAPTMEN1KMT2ANPSR1LMNA
SCHEMBL11464005 0.78 CYP3A4 (0.62) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL28472108 0.78 MEN1 (0.49) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL11464001 0.77 TSHR (0.54) MAPTMEN1KMT2ANPSR1LMNA
SCHEMBL27588745 0.77 MEN1 (0.62) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL875812 0.75 MEN1 (1.00) MAPTMEN1KMT2ALMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0227055-B1 INSECTICIDAL PYRAZOLINES SCHERING AKTIENGESELLSCHAFT (DE) 1991-08-07 EP disclosed
US-4888340-A Insecticides pyrazolines, compositions and use SCHERING AKTIENGESELLSCHAFT (DE) 1989-12-19 US disclosed
EP-0227055-A1 Insecticidal pyrazolines SCHERING AKTIENGESELLSCHAFT (DE) 1987-07-01 EP disclosed
EP-0058424-B1 PYRAZOLINE DERIVATIVES NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1985-09-18 EP disclosed
EP-0058424-A2 Pyrazoline derivatives NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1982-08-25 EP disclosed