SCHEMBL7236411

SCHEMBL7236411

CC(C)(C)OC(=O)N1C(=O)CCC1c1ccc(F)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.42
RORC P51449 3/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
TACR1 P25103 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
MMP13 P45452 1/20 0.37
HCRTR2 O43614 1/20 0.37
PRKCZ Q05513 1/20 0.36
GRM5 P41594 1/20 0.36
GRM1 Q13255 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36

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
SCHEMBL22039428 1.00 HTR7 (0.42) HTR7RORCMEN1KMT2ATDP1
SCHEMBL27528621 0.87 RORC (0.46) RORCL3MBTL1DDB1CRBNPRKCZ
SCHEMBL29779454 0.87 RORC (0.46) RORCL3MBTL1DDB1CRBNPRKCZ
SCHEMBL29779329 0.87 RORC (0.46) RORCL3MBTL1DDB1CRBNPRKCZ
SCHEMBL7589379 0.86 L3MBTL1 (0.51) RORCMEN1KMT2AL3MBTL1
SCHEMBL5620456 0.85 LIPE (0.47) L3MBTL1HCRTR2
SCHEMBL3496027 0.84 GPR119 (0.47) L3MBTL1
SCHEMBL7233985 0.84 KDM1A (0.46) MEN1KMT2AL3MBTL1DDB1CRBN
SCHEMBL7193226 0.82 GPR119 (0.50) L3MBTL1HCRTR2
SCHEMBL7043305 0.82 DRD2 (0.40) RORCKMT2AL3MBTL1

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
CN-111217802-B Histone acetylase p300 inhibitor and application thereof 海创药业股份有限公司 2021-10-08 CN disclosed
CN-111217802-A Histone acetylase p300 inhibitor and application thereof 成都海创药业有限公司 2020-06-02 CN disclosed
US-6599924-B1 2-hetaryl-3,4 dihydro-2H-pyrrole pesticide BAYER AKTIENGESELLSCHAFT (DE) 2003-07-29 US disclosed
CN-1323304-A 2-hetaryl-3,4-dihydro-2h-pyrrole derivatives BAYER AG (DE) 2001-11-21 CN disclosed
EP-1121357-A1 2-HETARYL-3,4-DIHYDRO-2H-PYRROLE DERIVATIVES Bayer Aktiengesellschaft (DE) 2001-08-08 EP disclosed
WO-2000021958-A1 2-HETARYL-3,4-DIHYDRO-2H-PYRROLE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2000-04-20 WO disclosed