SCHEMBL9423246

SCHEMBL9423246

O=[N+]([O-])c1ccc(CCc2ccc3ccccc3c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
ALPG P10696 1/20 0.55
TSHR P16473 1/20 0.53
POLB P06746 2/20 0.49
KDM4E B2RXH2 1/20 0.49
GLA P06280 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CNR2 P34972 2/20 0.48
CNR1 P21554 1/20 0.48
CYP1A2 P05177 2/20 0.47
CYP2C19 P33261 1/20 0.47
KCNJ1 P48048 1/20 0.47
KCNH2 Q12809 1/20 0.47
CYP19A1 P11511 2/20 0.47
LOXL2 Q9Y4K0 1/20 0.47
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
APOBEC3A P31941 1/20 0.47

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
SCHEMBL13946243 0.81 CYP1A2 (0.67) MAPTMEN1KMT2ATSHRKDM4E
SCHEMBL3292782 0.81 TSHR (0.75) TSHRPOLBCYP1A2CYP2C19KCNJ1
SCHEMBL9423244 0.80 MAOA (0.51) MAPTMEN1KMT2AALPGPOLB
SCHEMBL29929890 0.79 LMNA (0.56) MAPTMEN1KMT2AALPGTSHR
SCHEMBL57616 0.79 LMNA (0.56) MAPTMEN1KMT2AALPGTSHR
SCHEMBL27583120 0.79 ALDH1A1 (0.65) MAPTMEN1KMT2ATSHRCYP1A2
SCHEMBL6240981 0.79 CYP1A2 (0.65) KMT2ACYP1A2
SCHEMBL29560700 0.79 CYP1A2 (0.65) KMT2ACYP1A2
SCHEMBL9514129 0.79 CYP1A2 (0.49) MAPTMEN1KMT2AALPGCNR2
SCHEMBL8670812 0.77 PLAU (0.59) KMT2ACYP1A2MAOAMAOB

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-7445881-B2 Method of manufacturing semiconductor device, acid etching resistant material and copolymer KABUSHIKI KAISHA TOSHIBA (JP) 2008-11-04 US disclosed
US-20070138139-A1 METHOD OF MANUFACTURING SEMICONDUCTOR DEVICE, ACID ETCHING RESISTANCE MATERIAL AND COPOLYMER ASAKAWA KOJI 2007-06-21 US disclosed
US-5356889-A Carbapenicillins MERCK & CO., INC. (US) 1994-10-18 US disclosed
EP-0472306-A1 2-(9-fluorenonyl)-carbapenem antibacterial agents MERCK & CO. INC. (US) 1992-02-26 EP disclosed