SCHEMBL28293385

SCHEMBL28293385

Cc1cc(C=O)n(-c2ccc(Cl)cc2)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.55
GAA P10253 6/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
PTGS2 P35354 1/20 0.46
HPGD P15428 2/20 0.46
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
NPY1R P25929 1/20 0.45
NPY2R P49146 1/20 0.45
LMNA P02545 3/20 0.43
MAPT P10636 3/20 0.43
ALPG P10696 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ALOX12 P18054 1/20 0.42
HTT P42858 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
PPP1CA P62136 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
SCHEMBL28293268 0.86 SMN1; SMN2 (0.43) POLBSMN1; SMN2MEN1KMT2AHPGD
SCHEMBL28295432 0.84 GAA (0.55) POLBGAASMN1; SMN2MEN1KMT2A
SCHEMBL28872888 0.83 KCNJ6 (0.44) SMN1; SMN2MEN1KMT2APTGS2LMNA
SCHEMBL2514163 0.83 MAPK1 (0.56) GAASMN1; SMN2HPGDKDM4EALDH1A1
SCHEMBL28872885 0.81 LMNA (0.60) POLBGAASMN1; SMN2MEN1KMT2A
SCHEMBL28295435 0.80 POLB (0.43) POLBMEN1KMT2APTGS2HPGD
SCHEMBL27868556 0.80 GAA (0.56) POLBGAASMN1; SMN2MEN1KMT2A
SCHEMBL27868554 0.78 MAPT (0.38) POLBGAASMN1; SMN2HPGDALDH1A1
SCHEMBL27973503 0.77 POLB (0.55) POLBGAASMN1; SMN2KDM4EALDH1A1
Phosphine SCHEMBL28064259 0.77 PTGS2 (0.58) POLBSMN1; SMN2PTGS2ALDH1A1LMNA

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-109651253-A Cinnamic acid ester derivant and its application as nerve protection medicine 上海医药工业研究院 2019-04-19 CN disclosed
CN-109640934-A Method of increasing the absorption and washfastness of hair health compounds 宝洁公司 2019-04-16 CN disclosed