SCHEMBL9372384

SCHEMBL9372384

Cc1cc(C)c(C2=C(OC(=O)C(C)(C)C)CN(C)C2=O)c(C)c1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.34
▸ NPSR1 Q6W5P4 3/20 0.32
▸ HTT P42858 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ MAPT P10636 2/20 0.32
▸ POLB P06746 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ PARP1 P09874 1/20 0.30
▸ LMNA P02545 1/20 0.30

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
SCHEMBL13817854 0.73 HTR2A (0.38) ELANEMEN1KMT2AMAPT
SCHEMBL37164 0.70 — —
SCHEMBL4249639 0.70 ELANE (0.36) ELANENPSR1MAPTPOLBGAA
SCHEMBL15763653 0.69 ELANE (0.32) ELANE
SCHEMBL17193409 0.69 ELANE (0.34) ELANE
SCHEMBL15757241 0.69 ELANE (0.34) ELANE
SCHEMBL19531486 0.69 ELANE (0.33) ELANE
SCHEMBL10326979 0.69 ELANE (0.33) ELANELMNA
SCHEMBL9580536 0.67 CRHR1 (0.33) —
SCHEMBL10327222 0.66 EGFR (0.33) ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2225459-A — — None — — JP disclosed
EP-0377893-B1 3-Aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1994-04-06 — — EP disclosed
US-5186737-A Herbicides BAYER AKTIENGESELLSCHAFT (DE) 1993-02-16 — — US disclosed
US-5045560-A Insecticides, nematocides, fungicides, herbicides, human and veterinary medicine BAYER AKTIENGESELLSCHAFT (DE) 1991-09-03 — — US disclosed
JP-H02225459-A PESTICIDAL TAUTOMER OF 3-ARYLPYRROLIDINE-2,4-DIONE DERIVATIVE BAYER AG 1990-09-07 — — JP disclosed
EP-0377893-A2 3-Aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1990-07-18 — — EP disclosed
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