SCHEMBL8594796

SCHEMBL8594796

CCCCCCC(=O)Nc1ccc(OCC(C)C(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.62
▸ GAA P10253 1/20 0.62
▸ CNR1 P21554 2/20 0.56
▸ PPARA Q07869 1/20 0.52
▸ SOAT2 O75908 1/20 0.51
▸ SOAT1 P35610 1/20 0.51
▸ HDAC8 Q9BY41 5/20 0.50
▸ HDAC3 O15379 3/20 0.50
▸ HDAC6 Q9UBN7 3/20 0.50
▸ HDAC1 Q13547 2/20 0.50
▸ HDAC2 Q92769 2/20 0.50
▸ ENPP2 Q13822 1/20 0.50
▸ DGAT2 Q96PD7 1/20 0.50
▸ PSMB11 A5LHX3 1/20 0.50
▸ PSMA7 O14818 1/20 0.50
▸ PSMB1 P20618 1/20 0.50
▸ PSMA1 P25786 1/20 0.50
▸ PSMA2 P25787 1/20 0.50
▸ PSMA3 P25788 1/20 0.50
▸ PSMA4 P25789 1/20 0.50

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
SCHEMBL14977512 1.00 L3MBTL1 (0.62) L3MBTL1GAACNR1PPARASOAT2
SCHEMBL14977426 1.00 L3MBTL1 (0.62) L3MBTL1GAACNR1PPARASOAT2
SCHEMBL14977147 1.00 L3MBTL1 (0.62) L3MBTL1GAACNR1PPARASOAT2
SCHEMBL8594556 0.83 EPHX2 (0.60) CNR1CNR2
SCHEMBL11642285 0.83 POLB (0.69) L3MBTL1GAACNR1HDAC8HDAC3
SCHEMBL8443095 0.83 POLB (0.69) L3MBTL1GAACNR1HDAC8HDAC3
SCHEMBL10652806 0.83 POLB (0.69) L3MBTL1GAACNR1HDAC8HDAC3
SCHEMBL8627520 0.81 NPC1 (0.61) L3MBTL1GAAS1PR1S1PR3
SCHEMBL11501423 0.81 L3MBTL1 (0.55) L3MBTL1
SCHEMBL18259440 0.80 CNR1 (0.68) L3MBTL1GAACNR1SOAT2SOAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5927283-A TREATING DISEASES INVOLVING OXYGEN DEFICIENCY, IN WOUND HEALING, AND IN RESTORING OXYGEN AFFINITY OF STORED BLOOD. VIRGINIA COMMONWEALTH UNIVERSITY (US) 1999-07-27 — — US disclosed
US-5872282-A MAINTAIN OXYGEN AFFINITY IN BLOOD WHEN STORED VIRGINIA COMMONWEALTH UNIVERSITY (US) 1999-02-16 — — US disclosed
US-5731454-A Allosteric modifiers of hemoglobin useful for decreasing oxygen affinity and preserving oxygen carrying capability of stored blood VIRGINIA COMMONWEALTH UNIVERSITY (US) 1998-03-24 — — US disclosed
US-5705521-A Use of allosteric hemoglobin modifiers in combination with radiation therapy to treat carcinogenic tumors THE CENTER FOR INNOVATIVE TECHNOLOGY (US) 1998-01-06 — — US disclosed
US-5677330-A THERAPY HYPOXIA, HYPOTHERMIA, ISCHEMIC, WOUNDS, ULCERS, TISSUE TRANSPLANTS, SESPIS THE CENTER FOR INNOVATIVE TECHNOLOGY (US) 1997-10-14 — — US disclosed
Send feedback