SCHEMBL10619381

SCHEMBL10619381

CCCCCC(O)C=CC1CCC(=O)C1C(O)CCCCCC(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 8/20 0.48
▸ PTGER2 P43116 8/20 0.48
▸ PTGER3 P43115 7/20 0.48
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ GALR3 O60755 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ HKDC1 Q2TB90 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ SAE1 Q9UBE0 1/20 0.45
▸ UBA2 Q9UBT2 1/20 0.45
▸ TSHR P16473 2/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ ABCC3 O15438 1/20 0.42
▸ ABCC4 O15439 1/20 0.42
▸ RARB P10826 1/20 0.42
▸ RARG P13631 1/20 0.42

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
SCHEMBL11723868 0.85 MEN1 (0.63) PTGER4PTGER2PTGER3MEN1KMT2A
SCHEMBL11250679 0.84 PTGER2 (0.40) PTGER4PTGER2PTGER3MEN1KMT2A
SCHEMBL11250676 0.84 PTGER2 (0.40) PTGER4PTGER2PTGER3MEN1KMT2A
SCHEMBL11863993 0.84 MEN1 (0.61) PTGER4PTGER2PTGER3MEN1KMT2A
SCHEMBL11864006 0.84 MEN1 (0.61) PTGER4PTGER2PTGER3MEN1KMT2A
SCHEMBL11864001 0.84 MEN1 (0.61) PTGER4PTGER2PTGER3MEN1KMT2A
SCHEMBL28339789 0.81 PTGER4 (0.48) PTGER4PTGER2PTGER3MEN1KMT2A
SCHEMBL11251902 0.81 PTGER2 (0.52) PTGER4PTGER2PTGER3MEN1KMT2A
SCHEMBL11044232 0.80 PTGIR (0.58) PTGER4PTGER2PTGER3MEN1KMT2A
SCHEMBL10621611 0.80 PTGIR (0.58) PTGER4PTGER2PTGER3MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4766147-A ANTITUMOR AGENTS TEIJIN LIMITED (JP) 1988-08-23 — — US disclosed
EP-0106576-B1 NOVEL 5-MEMBERED CYCLIC COMPOUNDS, PROCESS FOR THE PRODUCTION THEREOF, AND PHARMACEUTICAL USE THEREOF TEIJIN LIMITED (JP) 1988-03-09 — — EP disclosed
EP-0106576-A2 Novel 5-membered cyclic compounds, process for the production thereof, and pharmaceutical use thereof TEIJIN LIMITED (JP) 1984-04-25 — — EP disclosed
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