SCHEMBL28108317

SCHEMBL28108317

COC(=O)C1Oc2ccccc2OC1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
MAPT P10636 1/20 0.45
ITGA4 P13612 1/20 0.45
POLB P06746 3/20 0.45
AGER Q15109 2/20 0.40
CYP2D6 P10635 2/20 0.39
HTT P42858 1/20 0.39
TSHR P16473 2/20 0.38
P2RX4 Q99571 1/20 0.38
LMNA P02545 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP1A2 P05177 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CASP6 P55212 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL28108315 0.93 ALDH1A1 (0.50) ALDH1A1MAPTITGA4POLBAGER
SCHEMBL10974720 0.84 POLB (0.47) ALDH1A1POLBHTTLMNACASP6
SCHEMBL10974722 0.84 POLB (0.47) ALDH1A1POLBHTTLMNACASP6
SCHEMBL28108305 0.79 PTGS1 (0.37) ALDH1A1MAPTITGA4LMNA
SCHEMBL28325988 0.77 PPM1B (0.36) ALDH1A1MAPTITGA4POLBCYP2D6
SCHEMBL440743 0.77 ALDH1A1 (0.42) ALDH1A1MAPTITGA4POLBCYP2D6
SCHEMBL3780431 0.77 GABRA1 (0.41) ALDH1A1MAPTITGA4POLBCYP2D6
SCHEMBL13743941 0.76 ALDH1A1 (0.43) ALDH1A1MAPTITGA4POLBAGER
SCHEMBL30683831 0.76 ALDH1A1 (0.46) ALDH1A1MAPTITGA4POLBAGER
SCHEMBL11645792 0.76 POLB (0.55) ALDH1A1POLBAGERHTTCASP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105985466-B Ziegler-Natta type catalyst, process for its preparation and catalyst system 中国石油天然气股份有限公司 2018-07-10 CN claimed
CN-105985466-A Ziegler-Natta type catalyst, process for its preparation and catalyst system 中国石油天然气股份有限公司 2016-10-05 CN claimed
CN-105985466-B Ziegler-Natta type catalyst, process for its preparation and catalyst system 中国石油天然气股份有限公司 2018-07-10 CN disclosed
CN-105985466-A Ziegler-Natta type catalyst, process for its preparation and catalyst system 中国石油天然气股份有限公司 2016-10-05 CN disclosed