SCHEMBL9215281

SCHEMBL9215281

O=C(O[CH]Cl)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
F2 P00734 1/20 0.56
TSHR P16473 4/20 0.52
TDP1 Q9NUW8 4/20 0.47
TP53 P04637 1/20 0.47
PLA2G7 Q13093 1/20 0.46
ALDH1A1 P00352 6/20 0.45
KMT2A Q03164 3/20 0.45
MAPK1 P28482 3/20 0.45
MAPT P10636 2/20 0.45
HIF1A Q16665 2/20 0.45
POLB P06746 1/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
CES2 O00748 2/20 0.44
CES1 P23141 2/20 0.44
DAO P14920 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL8387828 0.83 LMNA (0.52) LMNAF2TSHRTDP1TP53
SCHEMBL28182671 0.81 LMNA (0.61) LMNAF2TSHRTDP1TP53
SCHEMBL11229507 0.81 LMNA (0.61) LMNAF2TSHRTDP1TP53
Benzoic Acid Vinyl Ester SCHEMBL8200509 0.81 LMNA (0.50) LMNAF2TSHRTDP1TP53
SCHEMBL229640 0.79 LMNA (0.58) LMNAF2TSHRTDP1TP53
Benzene SCHEMBL28103328 0.79 LMNA (0.58) LMNAF2TSHRTDP1TP53
SCHEMBL8422588 0.77 LMNA (0.56) LMNAF2TSHRTDP1TP53
SCHEMBL596915 0.77 LMNA (0.56) LMNAF2TSHRTDP1TP53
SCHEMBL21325951 0.77 LMNA (0.56) LMNAF2TSHRTDP1TP53
Ammonia Solution, Strong SCHEMBL4978199 0.77 LMNA (0.56) LMNAF2TSHRTDP1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2892343-A1 USE OF SUBSTITUTED 2,3-DIHYDRO-1-BENZOFURAN-4-CARBOXYLIC ACIDS OR SALTS THEREOF AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS Bayer CropScience AG (DE) 2015-07-15 EP disclosed
WO-2014037349-A1 USE OF SUBSTITUTED 2,3-DIHYDRO-1-BENZOFURAN-4-CARBOXYLIC ACIDS OR SALTS THEREOF AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2014-03-13 WO disclosed
EP-0389425-B1 Benzotiopyranyl amines CIBA GEIGY AG (CH) 1995-04-26 EP disclosed
US-5071858-A Antipsychotic benzothiopyranylamines CIBA-GEIGY CORPORATION (US) 1991-12-10 US disclosed
EP-0389425-A1 Benzotiopyranyl amines CIBA-GEIGY AG (CH) 1990-09-26 EP disclosed
EP-0002590-B1 NOVEL PROSTAGLANDIN COMPOUNDS, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AMERICAN CYANAMID COMPANY (US) 1981-09-30 EP disclosed