SCHEMBL4622707

SCHEMBL4622707

O=C(O)Cc1c[c]c[c]c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 1/20 0.48
▸ CA2 P00918 2/20 0.44
▸ CAMK2A Q9UQM7 1/20 0.44
▸ LMNA P02545 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ ABCC4 O15439 1/20 0.41
▸ PTGS1 P23219 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ HPGD P15428 3/20 0.40
▸ HSD17B10 Q99714 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ POLB P06746 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ RGS12 O14924 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ APEX1 P27695 1/20 0.40
▸ THPO P40225 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ GNAI1 P63096 1/20 0.40

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
SCHEMBL298153 0.80 AKR1B1 (0.48) AKR1B1CA2CAMK2ALMNAGAA
SCHEMBL5846956 0.73 CA2 (0.48) AKR1B1CA2CAMK2ALMNAGAA
SCHEMBL1197014 0.73 AKR1B1 (0.58) AKR1B1CA2CAMK2ALMNAGAA
SCHEMBL5847224 0.72 GABRA5 (0.42) AKR1B1CA2CAMK2ALMNAGAA
SCHEMBL10948644 0.70 AKR1B1 (0.54) AKR1B1CA2CAMK2ALMNAGAA
SCHEMBL238714 0.70 AKR1B1 (0.61) AKR1B1CA2CAMK2ALMNAGAA
SCHEMBL69614 0.69 CA2 (0.79) AKR1B1CA2CAMK2ALMNAGAA
SCHEMBL583915 0.69 AKR1B1 (0.60) AKR1B1CA2CAMK2ALMNAGAA
Phenylacetic Acid SCHEMBL10524559 0.69 AKR1B1 (0.94) AKR1B1CA2CAMK2ALMNAGAA
Phenylacetic Acid SCHEMBL27273848 0.69 AKR1B1 (0.94) AKR1B1CA2CAMK2ALMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0773248-B1 Polymers with heterocyclic side groups MISSISSIPPI POLYMER TECHNOLOGI (US) 2002-10-02 — — EP claimed
US-5668245-A PHENYLENE POLYMERS WITH HETEROCYCLIC SIDE GROUPS MAXDEM INCORPORATED (US) 1997-09-16 — — US claimed
EP-0773248-A1 Polymers with heterocyclic side groups MAXDEM INCORPORATED (US) 1997-05-14 — — EP claimed
EP-1219657-B1 POLYARYLENE AND METHOD FOR PRODUCTION THEREOF JAPAN SCIENCE & TECH AGENCY (JP) 2008-03-19 — — EP disclosed
US-6586554-B1 Polyarylene and method for production thereof JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2003-07-01 — — US disclosed
EP-0773248-B1 Polymers with heterocyclic side groups MISSISSIPPI POLYMER TECHNOLOGI (US) 2002-10-02 — — EP disclosed
EP-0773249-B1 Polyphenylene co-polymers MISSISSIPPI POLYMER TECHNOLOGI (US) 2002-10-02 — — EP disclosed
EP-1219657-A1 POLYARYLENE AND METHOD FOR PRODUCTION THEREOF Japan Science and Technology Corporation (JP) 2002-07-03 — — EP disclosed
US-5886130-A THE CO-POLYMERS ARE USEFUL AS MOLDING RESINS, AND COMPOSITE MATRIX RESINS, AND WHERE AR IS HETEROARYLENE AS ION EXCHANGE RESINS. MAXDEM INCORPORATED (US) 1999-03-23 — — US disclosed
US-5668245-A PHENYLENE POLYMERS WITH HETEROCYCLIC SIDE GROUPS MAXDEM INCORPORATED (US) 1997-09-16 — — US disclosed
EP-0773249-A1 Polyphenylene co-polymers MAXDEM INCORPORATED (US) 1997-05-14 — — EP disclosed
EP-0773248-A1 Polymers with heterocyclic side groups MAXDEM INCORPORATED (US) 1997-05-14 — — EP disclosed
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