SCHEMBL6433540

SCHEMBL6433540

CCCCCCCCCCCCCCCCCC1=C(C(=O)O)O1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 6/20 0.46
CDC25B P30305 6/20 0.46
CDC25C P30307 5/20 0.46
SCD O00767 1/20 0.43
RARB P10826 4/20 0.42
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
RARA P10276 1/20 0.42
MAPT P10636 1/20 0.42
MTOR P42345 1/20 0.42
PPARG P37231 4/20 0.40
PPARD Q03181 4/20 0.40
PPARA Q07869 4/20 0.40
TSHR P16473 3/20 0.40
GPR84 Q9NQS5 3/20 0.40
HDAC11 Q96DB2 3/20 0.40
BID P55957 2/20 0.40
BCL2L1 Q07817 2/20 0.40
MCL1 Q07820 2/20 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
SCHEMBL2731945 1.00 CDC25A (0.46) CDC25ACDC25BCDC25CSCDRARB
SCHEMBL40469 1.00 CDC25A (0.46) CDC25ACDC25BCDC25CSCDRARB
SCHEMBL10618311 0.98 CDC25A (0.43) CDC25ACDC25BCDC25CSCDRARB
SCHEMBL9332691 0.83
SCHEMBL7058414 0.82 CDC25A (0.41) CDC25ACDC25BCDC25CSCDRARB
SCHEMBL5269756 0.79 CDC25A (0.39) CDC25ACDC25BCDC25CSCDPPARG
SCHEMBL2128309 0.74 GPR84 (0.65) CDC25ACDC25BCDC25CSCDALDH1A1
SCHEMBL6478501 0.72 SCD (0.43) CDC25ACDC25BCDC25CSCDRARB
SCHEMBL14989170 0.68 BID (0.51) SCDRARBALDH1A1MEN1KMT2A
SCHEMBL19406563 0.68 BID (0.51) SCDRARBALDH1A1MEN1KMT2A

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
US-6916843-B1 Anti-inflammatory actions of cytochrome P450 expoxygenase-derived eicosanoids THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2005-07-12 US claimed
EP-1207877-A4 ANTI-INFLAMMATORY ACTIONS OF CYTOCHROME P450 EPOXYGENASE-DERIVED EICOSANOIDS BRIGHAM & WOMENS HOSPITAL (US) 2004-06-09 EP claimed
EP-1207877-A1 ANTI-INFLAMMATORY ACTIONS OF CYTOCHROME P450 EPOXYGENASE-DERIVED EICOSANOIDS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2002-05-29 EP claimed
WO-2001010438-A1 ANTI-INFLAMMATORY ACTIONS OF CYTOCHROME P450 EPOXYGENASE-DERIVED EICOSANOIDS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2001-02-15 WO claimed
US-6916843-B1 Anti-inflammatory actions of cytochrome P450 expoxygenase-derived eicosanoids THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2005-07-12 US disclosed
EP-1207877-A4 ANTI-INFLAMMATORY ACTIONS OF CYTOCHROME P450 EPOXYGENASE-DERIVED EICOSANOIDS BRIGHAM & WOMENS HOSPITAL (US) 2004-06-09 EP disclosed
EP-1207877-A1 ANTI-INFLAMMATORY ACTIONS OF CYTOCHROME P450 EPOXYGENASE-DERIVED EICOSANOIDS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2002-05-29 EP disclosed
WO-2001010438-A1 ANTI-INFLAMMATORY ACTIONS OF CYTOCHROME P450 EPOXYGENASE-DERIVED EICOSANOIDS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2001-02-15 WO disclosed