SCHEMBL9517294

SCHEMBL9517294

[CH]1CC[C@@H](c2ccc(Oc3ccccc3)cc2)C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.49
MAOA P21397 1/20 0.45
LTA4H P09960 3/20 0.44
TSHR P16473 1/20 0.44
KCNH2 Q12809 1/20 0.41
SCN3A Q9NY46 1/20 0.41
NR1H2 P55055 1/20 0.41
BAX Q07812 1/20 0.41
MMP3 P08254 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
NLRP3 Q96P20 1/20 0.38
CYP19A1 P11511 1/20 0.38
MAOB P27338 1/20 0.37

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
SCHEMBL9517286 1.00 KDM1A (0.49) KDM1AMAOALTA4HTSHRKCNH2
SCHEMBL3970721 0.82 KDM1A (0.57) KDM1AMAOALTA4HTSHRKCNH2
SCHEMBL19322267 0.82 KDM1A (0.57) KDM1AMAOALTA4HTSHRKCNH2
SCHEMBL385172 0.82 SLC18A3 (0.48)
SCHEMBL8710331 0.79 KDM1A (0.53) KDM1ALTA4HTSHRNR1H2BAX
SCHEMBL26154062 0.79 KDM1A (0.53) KDM1AMAOALTA4HTSHRKCNH2
SCHEMBL25187440 0.77 DRD2 (0.47) KDM1AMAOASLC6A2SLC6A4SLC6A3
SCHEMBL7702531 0.77 HAO1 (0.53) KDM1ALTA4HTSHRKCNH2HRH3
SCHEMBL7698322 0.74 KDM1A (0.58) KDM1AMAOALTA4HTSHRKCNH2
SCHEMBL949252 0.74 SLC18A3 (0.68) KDM1ALTA4HSLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0559743-A1 NOVEL HYDROXAMIC ACID AND N-HYDROXYUREA DERIVATIVES AND THEIR USE. PFIZER HOSPITAL PROD (US) 1993-09-15 EP disclosed
WO-1992009566-A1 NOVEL HYDROXAMIC ACID AND N-HYDROXYUREA DERIVATIVES AND THEIR USE PFIZER INC. (US) 1992-06-11 WO disclosed