SCHEMBL9507359

SCHEMBL9507359

C=CC(N)Oc1ccccc1Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
HRH1 P35367 1/20 0.40
CTNNB1 P35222 1/20 0.40
ALDH1A1 P00352 2/20 0.39
TSHR P16473 2/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 2/20 0.38
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LTA4H P09960 1/20 0.38
KDM1A O60341 2/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
HTR1A P08908 1/20 0.38
SLC6A3 Q01959 1/20 0.38
DPP4 P27487 1/20 0.38
MAOA P21397 1/20 0.35
RIPK1 Q13546 1/20 0.35

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
SCHEMBL9501295 0.81 MAOA (0.47) KMT2ATSHRLTA4HMAOA
SCHEMBL527140 0.81 SCN4A (0.36) ALDH1A1TSHRLTA4HSLC6A4DPP4
SCHEMBL9772667 0.75 LMNA (0.42) LMNAGAAKMT2AHRH1CTNNB1
SCHEMBL8553833 0.74 TSHR (0.42) LMNAGAAALDH1A1TSHRHPGD
SCHEMBL51822 0.73 LTA4H (0.69) LMNAGAAKMT2AHRH1CTNNB1
SCHEMBL3232712 0.72 KDM4E (0.49) LMNAKMT2ACTNNB1ALDH1A1TSHR
SCHEMBL11333948 0.72 HTT (0.42) LMNAGAAKMT2ACTNNB1ALDH1A1
SCHEMBL11124897 0.71 HTR1B (0.43) KMT2AALDH1A1HPGDSLC6A2SLC6A4
SCHEMBL24926216 0.71 ALDH1A1 (0.50) LMNAGAAKMT2AALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL7127955 0.71 LTA4H (0.65) LMNAGAAKMT2AHRH1CTNNB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0412391-B1 CYCLOPROPANE THIOCARBOXYLIC ACID AMIDES BASF Aktiengesellschaft (DE) 1993-09-29 EP claimed
JP-2221245-A None JP disclosed
JP-H02221245-A PHENOXYPHENOXYALKYLAMINE DERIVATIVE, PRODUCTION THEREOF AND INSECTICIDE NIPPON SODA CO LTD 1990-09-04 JP disclosed