SCHEMBL30438896

SCHEMBL30438896

COP(=O)(O)Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
ACP3 P15309 2/20 0.46
MAPT P10636 1/20 0.45
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
MMP2 P08253 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
LMNA P02545 1/20 0.43
PGK1 P00558 1/20 0.42
PGK2 P07205 1/20 0.42
PPARG P37231 4/20 0.42
PPARA Q07869 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
CES2 O00748 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL30438735 0.84 ACP3 (0.49) KDM4EACP3MAPTCA12CA1
SCHEMBL22321979 0.83 SRC (0.53) KDM4EACP3CA12CA1MMP2
SCHEMBL22321978 0.80 KDM4E (0.50) KDM4EACP3CA12CA1MMP2
SCHEMBL28868959 0.78 HCRTR1 (0.53) CA1LMNACES2L3MBTL1ALDH1A1
SCHEMBL1276968 0.78 KDM4E (0.49) KDM4EACP3CA12CA1MMP2
SCHEMBL10837943 0.78 KDM4E (0.46) KDM4EACP3MAPTLMNAPPARG
SCHEMBL10837937 0.78 LMNA (0.48) KDM4EACP3MAPTNPSR1LMNA
SCHEMBL31010503 0.77 ACHE (0.45) LMNAPGK1PGK2CYP2C19L3MBTL1
SCHEMBL28219510 0.77 CYP3A4 (0.49) CA12LMNAALDH1A1
SCHEMBL13301844 0.76 ALDH1A1 (0.48) KDM4EACP3MAPTNPSR1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113707816-B Preparation method of perovskite solar cell 江苏盛开高新材料有限公司 2023-07-04 CN disclosed