SCHEMBL10475651

SCHEMBL10475651

O=C(O)CC[C@@H]1CCC(=O)N1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 4/20 0.46
▸ PTGER3 P43115 3/20 0.46
▸ PTGER2 P43116 2/20 0.46
▸ MTNR1A P48039 5/20 0.46
▸ EHMT2 Q96KQ7 1/20 0.44
▸ P2RX7 Q99572 1/20 0.44
▸ MTNR1B P49286 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
SCHEMBL31706028 0.85 ITGB1 (0.47) MTNR1AEHMT2P2RX7MTNR1B
SCHEMBL20193827 0.85 HCRTR1 (0.46) MTNR1AEHMT2P2RX7
SCHEMBL10474630 0.83 MTNR1A (0.45) MTNR1AP2RX7
SCHEMBL16509689 0.82 MTNR1A (0.47) MTNR1AEHMT2
SCHEMBL30829326 0.82 HCRTR1 (0.47) MTNR1AEHMT2P2RX7MTNR1B
SCHEMBL7275111 0.82 HCRTR1 (0.47) MTNR1AEHMT2P2RX7MTNR1B
SCHEMBL7275104 0.82 HCRTR1 (0.47) MTNR1AEHMT2P2RX7MTNR1B
SCHEMBL6703838 0.80 TP53 (0.46) MTNR1AEHMT2P2RX7MTNR1B
SCHEMBL10474764 0.80 P2RX7 (0.44) MTNR1AP2RX7MTNR1B
SCHEMBL10785525 0.80 MEN1 (0.46) P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1990012787-A1 ENANTIOMER-PURE 5-OXO-2-PYRROLIDINE-PROPANE ACIDS ALKYLATED IN POSITION 1 AND THEIR ESTERS; THEIR PRODUCTION AND USE FLEISCHHACKER WILHELM (AT) 1990-11-01 — — WO claimed
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