SCHEMBL28360700

SCHEMBL28360700

C=CCc1ccc(-n2nc3ccc(Cl)cc3n2)c(O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.45
MAPT P10636 4/20 0.41
GABRA1 P14867 4/20 0.41
GABRB2 P47870 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 2/20 0.41
GAA P10253 2/20 0.41
CNR1 P21554 2/20 0.41
CNR2 P34972 2/20 0.41
KDM4E B2RXH2 2/20 0.41
AKR1B1 P15121 2/20 0.41
ALDH2 P05091 1/20 0.41
HPGD P15428 1/20 0.41
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TNKS O95271 1/20 0.39
PARP1 P09874 1/20 0.39
ALOX5 P09917 5/20 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
SCHEMBL11668225 0.90 XDH (0.45) XDHMAPTGABRA1GABRB2MEN1
SCHEMBL9638427 0.83 TRPA1 (0.41) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL11468541 0.83 RXFP1 (0.38) MAPTMEN1KMT2AKDM4EAKR1B1
SCHEMBL9638398 0.81 CNR2 (0.40) MAPTALDH1A1GAACNR1CNR2
SCHEMBL2731448 0.80 XDH (0.45) XDHMAPTGABRA1GABRB2MEN1
SCHEMBL7166175 0.80 NPC1 (0.36) XDHMAPTGABRA1GABRB2MEN1
SCHEMBL30383298 0.78 MAPT (0.41) MAPTMEN1KMT2AALDH1A1GAA
SCHEMBL2800533 0.78 MAPT (0.41) MAPTMEN1KMT2AALDH1A1GAA
SCHEMBL14017578 0.77 MAOB (0.40) MAPTKMT2AKDM4EHPGDNPSR1
SCHEMBL1004621 0.76 TNKS (0.45) MAPTGABRA1GABRB2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109351213-B Polyvinylidene fluoride composite membrane containing modified polydopamine nanoparticles and preparation method thereof 中国科学院长春应用化学研究所 2020-07-28 CN claimed
CN-108047383-B Preparation method of polyvinylidene fluoride copolymer 中国科学院长春应用化学研究所 2020-03-17 CN claimed
CN-109673334-B Heat-preservation, aging-resistant and fog-dissipation agricultural greenhouse film and preparation method thereof 江苏智信塑胶科技有限公司 2021-08-31 CN disclosed
CN-109351213-B Polyvinylidene fluoride composite membrane containing modified polydopamine nanoparticles and preparation method thereof 中国科学院长春应用化学研究所 2020-07-28 CN disclosed
CN-108047383-B Preparation method of polyvinylidene fluoride copolymer 中国科学院长春应用化学研究所 2020-03-17 CN disclosed