SCHEMBL29959920

SCHEMBL29959920

COc1cccc(NC=O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
MAPK1 P28482 2/20 0.56
HSD17B10 Q99714 1/20 0.56
KMT2A Q03164 5/20 0.56
MEN1 O00255 4/20 0.56
POLB P06746 1/20 0.56
NPC1 O15118 7/20 0.52
RAB9A P51151 7/20 0.52
MAPT P10636 3/20 0.51
TP53 P04637 2/20 0.51
TSHR P16473 1/20 0.51
RXFP1 Q9HBX9 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
NFKB1 P19838 2/20 0.51
NFKB2 Q00653 2/20 0.51
RELA Q04206 2/20 0.51
STAT1 P42224 1/20 0.51
NLRP3 Q96P20 1/20 0.50
LMNA P02545 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL1188678 1.00 ALDH1A1 (0.56) ALDH1A1MAPK1HSD17B10KMT2AMEN1
SCHEMBL10133726 0.81 ALDH1A1 (0.41) ALDH1A1MAPK1HSD17B10KMT2AMEN1
SCHEMBL3844768 0.81 ALDH1A1 (0.53) ALDH1A1MAPK1HSD17B10KMT2AMEN1
SCHEMBL8279430 0.81 ALDH1A1 (0.53) ALDH1A1MAPK1HSD17B10KMT2AMEN1
SCHEMBL2091337 0.80 ALDH1A1 (0.44) ALDH1A1MAPK1HSD17B10KMT2AMEN1
SCHEMBL8705839 0.80 ALDH1A1 (0.44) ALDH1A1MAPK1HSD17B10KMT2AMEN1
SCHEMBL2092157 0.80 PLAU (0.50) ALDH1A1HSD17B10KMT2AMEN1NPC1
SCHEMBL1187511 0.80 HTT (0.55) ALDH1A1MAPK1HSD17B10KMT2AMEN1
SCHEMBL6560140 0.79 ALDH1A1 (0.50) ALDH1A1KMT2AMEN1POLBNPC1
SCHEMBL1347464 0.79 ALDH1A1 (0.47) ALDH1A1MAPK1HSD17B10KMT2AMEN1

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-115043750-B Method for preparing formamide by low pressure 中国科学院山西煤炭化学研究所 2023-12-26 CN disclosed
CN-115043750-A Method for preparing formamide under low pressure 中国科学院山西煤炭化学研究所 2022-09-13 CN disclosed