SCHEMBL7929762

SCHEMBL7929762

CCCCCCCCOc1c(Nc2c(Br)cccc2Br)c(Nc2c(Br)cccc2Br)c(F)c2c1C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.35
THRA P10827 3/20 0.35
THRB P10828 3/20 0.35
ELANE P08246 2/20 0.34
CTSG P08311 2/20 0.34
FAAH O00519 10/20 0.34

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
SCHEMBL7929940 0.96 ELANE (0.34) THRATHRBELANECTSGFAAH
SCHEMBL7933215 0.89 FAAH (0.38) SMPD1ELANECTSGFAAH
SCHEMBL7928353 0.88 ELANE (0.35) SMPD1THRATHRBELANECTSG
SCHEMBL7930360 0.88 ELANE (0.37) SMPD1ELANECTSGFAAH
SCHEMBL7928316 0.88 ELANE (0.34) SMPD1ELANECTSGFAAH
SCHEMBL7933295 0.87 ADAMTS5 (0.39) SMPD1FAAH
SCHEMBL7930019 0.84 ADAMTS5 (0.46) FAAH
SCHEMBL7929756 0.84 MAPK14 (0.35) ELANECTSG
SCHEMBL7927144 0.84 ELANE (0.35) ELANECTSGFAAH
SCHEMBL7929795 0.83 EGFR (0.39) ELANE

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
EP-0661350-B1 Quinizarin compound, method for production thereof, and use therefor NIPPON CATALYTIC CHEM IND (JP) 2001-08-22 EP disclosed
US-5817843-A Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1998-10-06 US disclosed
US-5608091-A SHEETS FOR HEAT EXCHANGING AND OPTICAL RECORDING MATERIAL NIPPON SHOKUBAI CO., LTD. (JP) 1997-03-04 US disclosed
EP-0661350-A1 Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1995-07-05 EP disclosed