SCHEMBL28815673

SCHEMBL28815673

O=C(Cl)c1cc(O)cc([N+](=O)[O-])c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.58
TSHR P16473 3/20 0.58
CYP3A4 P08684 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALOX15 P16050 2/20 0.46
CES1 P23141 2/20 0.43
CES2 O00748 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
GPR35 Q9HC97 2/20 0.42
TP53 P04637 1/20 0.42
ALOX5 P09917 2/20 0.40
CYP19A1 P11511 1/20 0.40
KDM4E B2RXH2 1/20 0.40
TTR P02766 1/20 0.40
CYP1A2 P05177 1/20 0.40
MAPT P10636 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL728757 0.88 ALDH1A1 (0.66) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL54880 0.88 ALDH1A1 (0.66) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL417424 0.82 CA1 (0.58) ALDH1A1TSHRCYP3A4SMN1; SMN2ALOX15
SCHEMBL31022463 0.82 CA1 (0.58) ALDH1A1TSHRCYP3A4SMN1; SMN2ALOX15
SCHEMBL12501661 0.81 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL7596117 0.81 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL30917331 0.81 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL11689544 0.81 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL1718794 0.81 CYP3A4 (0.78) ALDH1A1TSHRCYP3A4SMN1; SMN2ALOX15
SCHEMBL7112034 0.81 CA5A (0.59) ALDH1A1TSHRCYP3A4SMN1; SMN2ALOX15

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-114621437-B Compound for preparing photosensitive resin film, preparation method and application thereof 吉林奥来德光电材料股份有限公司 2023-08-18 CN disclosed
CN-114621437-A Compound for preparing photosensitive resin film, preparation method and application thereof 吉林奥来德光电材料股份有限公司 2022-06-14 CN disclosed