SCHEMBL4905768

SCHEMBL4905768

O=[N+]([O-])c1ccc(/N=N/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.79
▸ MEN1 O00255 6/20 0.79
▸ KMT2A Q03164 6/20 0.79
▸ CRHBP P24387 2/20 0.79
▸ CRHR2 Q13324 2/20 0.79
▸ L3MBTL1 Q9Y468 2/20 0.79
▸ ATM Q13315 1/20 0.79
▸ TLR9 Q9NR96 1/20 0.79
▸ RAB9A P51151 5/20 0.65
▸ MAPT P10636 5/20 0.65
▸ SMN1; SMN2 Q16637 4/20 0.65
▸ NPC1 O15118 4/20 0.65
▸ MAPK1 P28482 3/20 0.65
▸ TNNI3 P19429 1/20 0.65
▸ TNNT2 P45379 1/20 0.65
▸ TNNC1 P63316 1/20 0.65
▸ KEAP1 Q14145 1/20 0.65
▸ NFE2L2 Q16236 1/20 0.65
▸ CASP3 P42574 2/20 0.55
▸ SENP8 Q96LD8 2/20 0.55

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
SCHEMBL4905773 1.00 ALDH1A1 (0.79) ALDH1A1MEN1KMT2ACRHBPCRHR2
SCHEMBL1039452 0.89 ALDH1A1 (1.00) ALDH1A1MEN1KMT2ACRHBPCRHR2
SCHEMBL3853529 0.89 ALDH1A1 (1.00) ALDH1A1MEN1KMT2ACRHBPCRHR2
SCHEMBL17817838 0.89 ALDH1A1 (1.00) ALDH1A1MEN1KMT2ACRHBPCRHR2
SCHEMBL12957542 0.88 MEN1 (0.77) ALDH1A1MEN1KMT2ACRHBPCRHR2
SCHEMBL27732618 0.87 ALDH1A1 (0.96) ALDH1A1MEN1KMT2ACRHBPCRHR2
SCHEMBL29588234 0.85 MEN1 (0.66) ALDH1A1MEN1KMT2ACRHBPCRHR2
SCHEMBL270425 0.85 MEN1 (0.66) ALDH1A1MEN1KMT2ACRHBPCRHR2
SCHEMBL270426 0.85 MEN1 (0.66) ALDH1A1MEN1KMT2ACRHBPCRHR2
SCHEMBL8847808 0.85 ALDH1A1 (0.60) ALDH1A1MEN1KMT2ACRHBPCRHR2

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
US-20080002329-A1 High Dielectric, Non-Linear Capacitor POHM ARTHUR V 2008-01-03 — — US disclosed
US-20070206342-A1 High Dielectric, Non-Linear Nano-Capacitor NANO-ELECTROCHEM, INC. 2007-09-06 — — US disclosed
US-20060291278-A1 Nano-Reflectors for Thin, Flat Display Devices NANO-ELECTROCHEM, INC. (US) 2006-12-28 — — US disclosed
US-6288206-B1 MIXED WITH DYE; HEAT RESISTANCE, STABILITY; ELECTROOPTICS; MOLECULAR OPTOELECTRONICS CORPORATION 2001-09-11 — — US disclosed
WO-2000054103-A1 CHIRAL POLYMER COMPOSITIONS EXHIBITING NONLINEAR OPTICAL PROPERTIES MOLECULAR OPTOELECTRONICS CORPORATION (US) 2000-09-14 — — WO disclosed
Send feedback