SCHEMBL28026974

SCHEMBL28026974

COCc1cc(COC)cc(C(=O)Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLRA1 P23415 1/20 0.41
TP53 P04637 2/20 0.37
LMNA P02545 1/20 0.37
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
BRD4 O60885 1/20 0.35
CREBBP Q92793 1/20 0.35
HSP90AB1 P08238 1/20 0.34
HCAR2 Q8TDS4 1/20 0.34
PTPRC P08575 1/20 0.34
PTPRF P10586 1/20 0.34
PTPN1 P18031 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.33
PRKCE Q02156 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33

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
SCHEMBL163967 0.83 SMN1; SMN2 (0.41) GLRA1TP53LMNAALDH1A1BRD4
SCHEMBL5222576 0.83 MRGPRX4 (0.46) GLRA1ALDH1A1MRGPRX4RAB9AFFAR1
SCHEMBL2133327 0.81 MRGPRX4 (0.49) TP53LMNAALDH1A1LOXL2MRGPRX4
SCHEMBL10036558 0.81 GLRA1 (0.41) GLRA1TP53ALDH1A1PTPRCPTPRF
SCHEMBL5454978 0.81 BRD4 (0.47) TP53LMNAPOLBTDP1L3MBTL1
SCHEMBL9821352 0.79 NPC1 (0.43) GLRA1TP53LMNAALDH1A1POLB
SCHEMBL4572223 0.77 GLRA1 (0.41) GLRA1TP53ALDH1A1PTPRCPTPRF
SCHEMBL17395798 0.77 BRD4 (0.50) TP53LMNAPOLBTDP1L3MBTL1
SCHEMBL3624689 0.76 PRKCE (0.37) TP53LMNAALDH1A1POLBTDP1
SCHEMBL27775516 0.76 CA12 (0.39) TP53LMNAPOLBTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102776218-B Mutant receptors and their use in a nuclear receptor-based inducible gene expression system 因特莱克森公司 2017-04-12 CN disclosed
CN-1964622-B Mutant receptors and their use in nuclear receptor-based inducible gene expression systems INTREXON CORP. (US) 2015-08-26 CN disclosed