SCHEMBL8548121

SCHEMBL8548121

Cc1ccc2cc([N+](=O)[O-])c3ccc(C)nc3c2n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSB P07858 3/20 0.60
CTSH P09668 1/20 0.60
ALDH1A1 P00352 6/20 0.51
MAPT P10636 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CCR1 P32246 1/20 0.45
RAB9A P51151 1/20 0.45
CCR5 P51681 1/20 0.45
HPRT1 P00492 1/20 0.42
RELA Q04206 4/20 0.41
NFKBIA P25963 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
IDO1 P14902 1/20 0.40
TDO2 P48775 1/20 0.40
TSHR P16473 1/20 0.39
MITF O75030 1/20 0.38

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
SCHEMBL2312391 0.82 CTSB (0.68) CTSBCTSHALDH1A1MAPTL3MBTL1
SCHEMBL8545894 0.82 CTSB (0.46) CTSBCTSHALDH1A1MAPTL3MBTL1
SCHEMBL8674834 0.79 ALDH1A1 (0.49) CTSBCTSHALDH1A1MAPTL3MBTL1
SCHEMBL17011283 0.78 CCR1 (0.52) CTSBCTSHALDH1A1MAPTL3MBTL1
SCHEMBL8674260 0.77 ALDH1A1 (0.49) CTSBCTSHALDH1A1MAPTL3MBTL1
SCHEMBL1088606 0.77 CTSB (0.44) CTSBCTSHALDH1A1MAPTL3MBTL1
SCHEMBL20838491 0.77 CTSB (0.49) CTSBCTSHALDH1A1MAPTCCR1
SCHEMBL8544282 0.76 CCR1 (0.50) CTSBCTSHALDH1A1MAPTL3MBTL1
SCHEMBL8673214 0.76 MAPT (0.47) CTSBCTSHALDH1A1MAPTL3MBTL1
SCHEMBL10698487 0.75 CTSB (0.48) CTSBCTSHALDH1A1MAPTCCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0285978-A2 Substituted 1-(2-oxyaminosulfonyl-phenylsulfonyl)-3-(4-trifluoromethyl-pyrimidin-2-yl)-(thio)-ureas BAYER AG (DE) 1988-10-12 EP claimed
US-9110047-B2 Compound for forming fluorescent uranium complex, method for synthesizing thereof, fluorescent probe for detecting uranium and method for analyzing uranium JAPAN ATOMIC ENERGY AGENCY (JP) 2015-08-18 US disclosed
US-9110047-B2 Compound for forming fluorescent uranium complex, method for synthesizing thereof, fluorescent probe for detecting uranium and method for analyzing uranium JAPAN ATOMIC ENERGY AGENCY (JP) 2015-08-18 US disclosed
US-20130217135-A1 COMPOUND FOR FORMING FLUORESCENT URANIUM COMPLEX, METHOD FOR SYNTHESIZING THEREOF, FLUORESCENT PROBE FOR DETECTING URANIUM AND METHOD FOR ANALYZING URANIUM JAPAN ATOMIC ENERGY AGENCY (JP) 2013-08-22 US disclosed
US-5827653-A COMPLEMENTARY PROBE HYBRIDIZATION AND FORMATION OF A CHELATED LANTHANIDE COMPLEX, WHICH UPON IRRADIATION BY LIGHT, RESULTS IN A CHARACTERISTIC DELAYED LUMINESCENCE EMISSION ZENECA LIMITED (GB) 1998-10-27 US disclosed
EP-0624097-B1 TARGETING RADIOACTIVE IMMUNOREAGENTS NYCOMED IMAGING AS (NO) 1998-03-18 EP disclosed
US-5707603-A Pyridine complexing agents and targeting immunoreagents useful in therapeutic and diagnostic compositions NYCOMED IMAGING AS (NO) 1998-01-13 US disclosed
US-5677445-A DIAGNOSIS, THERAPY NYCOMED IMAGING AS (NO) 1997-10-14 US disclosed
EP-0720659-A1 NUCLEIC ACID DETECTION WITH ENERGY TRANSFER ZENECA LIMITED (GB) 1996-07-10 EP disclosed
US-5523402-A COMPLEXING AGENTS FOR TARGETING RADIOACTIVE IMMUNOREAGENTS STERLING WINTHROP INC. (US) 1996-06-04 US disclosed
WO-1995008642-A1 NUCLEIC ACID DETECTION WITH ENERGY TRANSFER ZENECA LIMITED (GB) 1995-03-30 WO disclosed
EP-0639083-A1 COMPLEXING AGENTS AND TARGETING IMMUNOREAGENTS NYCOMED IMAGING AS (NO) 1995-02-22 EP disclosed
US-5367080-A PYRIDINE DERIVATIVES STERLING WINTHROP INC. (US) 1994-11-22 US disclosed
EP-0624097-A1 TARGETING RADIOACTIVE IMMUNOREAGENTS NYCOMED IMAGING AS (NO) 1994-11-17 EP disclosed
US-5262526-A Fluorescent compound, complex, reagent, and specific binding assay employing said reagent DOJINDO LABORATORIES (JP) 1993-11-16 US disclosed
WO-1993021957-A1 COMPLEXING AGENTS AND TARGETING IMMUNOREAGENTS STERLING WINTHROP INC. (US) 1993-11-11 WO disclosed
EP-0493745-A1 Fluorescent compound, complex, reagent, and specific binding assay employing said reagent DOJINDO LABORATORIES (JP) 1992-07-08 EP disclosed
WO-1992008494-A2 TARGETING RADIOACTIVE IMMUNOREAGENTS STERLING WINTHROP INC. (US) 1992-05-29 WO disclosed
EP-0282893-A2 Pesticides based on 1,10-phenanthrolines BAYER AG (DE) 1988-09-21 EP disclosed