SCHEMBL11208809

SCHEMBL11208809

Cc1nc2ccc(OCCO)cc2nc1C

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 2/20 0.48
▸ PDE3A Q14432 2/20 0.48
▸ P2RY12 Q9H244 2/20 0.48
▸ PDE2A O00408 5/20 0.47
▸ PDE10A Q9Y233 4/20 0.47
▸ CA1 P00915 2/20 0.46
▸ MAOA P21397 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA4 P22748 1/20 0.46
▸ APP P05067 9/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ CASP1 P29466 1/20 0.43
▸ CASP7 P55210 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA9 Q16790 1/20 0.43

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
SCHEMBL11242184 0.81 ALDH1A1 (0.49) PDE2AMAOAALDH1A1CASP1CASP7
SCHEMBL11694010 0.80 MAPT (0.54) PDE3BPDE3ACA1CA2CA4
SCHEMBL11204494 0.80 TDP1 (0.44) PDE3BPDE3AP2RY12CA1CA2
SCHEMBL14304819 0.79 ALDH1A1 (0.56) PDE3BPDE3AP2RY12CA1CA2
SCHEMBL11237911 0.77 ALDH1A1 (0.40) CA1CA2CA4ALDH1A1CASP1
SCHEMBL8615953 0.75 CA1 (0.59) PDE3BPDE3AP2RY12PDE2ACA1
SCHEMBL4307797 0.74 HSD17B10 (0.56) PDE10ACA1CA2CA4ALDH1A1
SCHEMBL16307904 0.74 PDE3B (0.53) PDE3BPDE3AP2RY12PDE2AMAOA
SCHEMBL9072320 0.74 CA1 (0.61) CA1CA2CA4ALDH1A1HSD17B10
SCHEMBL10435667 0.74 KDM4E (0.70) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0014688-B1 PROCESS FOR THE TREATMENT OF SILVER DYE-BLEACHING MATERIALS, AQUEOUS PREPARATION THEREFOR, CONCENTRATE AND PROCESS FOR MAKING THE PREPARATION CIBA-GEIGY AG (CH) 1983-03-23 — — EP claimed
US-4304846-A USING MIXTURES OF A 1,4- OR 1,2-DIAZINE AS BLEACHING CATALYSTS; PREFERENTIAL REDOX POTENTIALS CIBA-GEIGY AG (CH) 1981-12-08 — — US claimed
EP-0014688-A2 Process for the treatment of silver dye-bleaching materials, aqueous preparation therefor, concentrate and process for making the preparation CIBA-GEIGY AG (CH) 1980-08-20 — — EP claimed
EP-0014688-B1 PROCESS FOR THE TREATMENT OF SILVER DYE-BLEACHING MATERIALS, AQUEOUS PREPARATION THEREFOR, CONCENTRATE AND PROCESS FOR MAKING THE PREPARATION CIBA-GEIGY AG (CH) 1983-03-23 — — EP disclosed
US-4323682-A BLEACHING CATALYSTS CIBA GEIGY AG (CH) 1982-04-06 — — US disclosed
US-4304846-A USING MIXTURES OF A 1,4- OR 1,2-DIAZINE AS BLEACHING CATALYSTS; PREFERENTIAL REDOX POTENTIALS CIBA-GEIGY AG (CH) 1981-12-08 — — US disclosed
EP-0014688-A2 Process for the treatment of silver dye-bleaching materials, aqueous preparation therefor, concentrate and process for making the preparation CIBA-GEIGY AG (CH) 1980-08-20 — — EP disclosed
US-4202698-A DYE BLEACH CATALYSTS CIBA-GEIGY AG (CH) 1980-05-13 — — US disclosed
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