SCHEMBL28852147

SCHEMBL28852147

O=P(O)(O)OCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.53
PTPN1 P18031 5/20 0.50
MAOB P27338 5/20 0.50
PTPN2 P17706 4/20 0.50
PTPN6 P29350 4/20 0.50
PTPRB P23467 3/20 0.50
PTPN11 Q06124 3/20 0.50
PTPRC P08575 2/20 0.50
KMT2A Q03164 1/20 0.50
CDC25A P30304 1/20 0.50
BTN3A1 O00481 1/20 0.48
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.44
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
SRD5A2 P31213 1/20 0.44
S1PR1 P21453 1/20 0.43

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
SCHEMBL17345002 0.84 TSHR (0.58) PTPN1PTPN2PTPN6PTPRBPTPN11
SCHEMBL20132840 0.81 NR4A2 (0.51) KMT2ATSHR
SCHEMBL31091013 0.80 ACP3 (0.64) IDO1MAOBALDH1A1
SCHEMBL31091007 0.79 TSHR (0.48) IDO1PTPN1MAOBPTPN2PTPN6
SCHEMBL8384625 0.78 TSHR (0.52) IDO1PTPN1KMT2ATSHR
SCHEMBL9449212 0.77 IDO1 (0.49) IDO1PTPN1MAOBPTPN2PTPN6
SCHEMBL28365963 0.76 TSHR (0.50) TSHRS1PR1
SCHEMBL13724836 0.76 PTPN1 (0.60) IDO1PTPN1MAOBPTPN2PTPN6
SCHEMBL19917829 0.75 TSHR (0.48) PTPN1PTPN2PTPN6PTPRBPTPN11
SCHEMBL4906498 0.75 TSHR (0.48) PTPN1PTPN2PTPN6PTPRBPTPN11

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-118678856-A Hole transport material, application thereof, solar cell and preparation method thereof 天合光能股份有限公司 2024-09-20 CN claimed
CN-118678856-A Hole transport material, application thereof, solar cell and preparation method thereof 天合光能股份有限公司 2024-09-20 CN disclosed
CN-115125553-B Electrochemical synthesis method of alcohol 绍兴久孚新材料科技有限公司 2023-12-22 CN disclosed
CN-115125553-A Electrochemical synthesis method of alcohol 绍兴久孚新材料科技有限公司 2022-09-30 CN disclosed