Formic Acid Methyl Ester

Formic Acid Methyl Ester

SCHEMBL31017385

CC(C)(C)OC(=O)Nc1ncccc1F.COC=O

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.41
ATR Q13535 1/20 0.41
NAMPT P43490 1/20 0.39
SYK P43405 1/20 0.39
RAB9A P51151 3/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
CYP17A1 P05093 3/20 0.37
RORC P51449 1/20 0.37
AAK1 Q2M2I8 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
NPC1 O15118 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL2260258 0.92 METAP1 (0.46) METAP1ATRNAMPTSYKRAB9A
SCHEMBL306384 0.79 METAP1 (0.44) METAP1ATRNAMPTRAB9AMAPT
SCHEMBL31419186 0.79 GAA (0.47) METAP1ATRNAMPTSYKRAB9A
SCHEMBL27611635 0.78 METAP1 (0.46) METAP1ATRNAMPTSYKRAB9A
SCHEMBL29919656 0.76 RAB9A (0.54) METAP1RAB9AMAPTHTTNPC1
SCHEMBL68279 0.76 RAB9A (0.54) METAP1RAB9AMAPTHTTNPC1
SCHEMBL15266282 0.76 METAP1 (0.56) METAP1ATRNAMPTRAB9ACYP17A1
SCHEMBL27967000 0.76 RAB9A (0.49) METAP1ATRNAMPTRAB9AMAPT
SCHEMBL15085418 0.76 ATR (0.45) METAP1ATRNAMPTSYKRAB9A
SCHEMBL5466767 0.76 LMNA (0.51) METAP1ATRNAMPTTRPV1LMNA

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-118401516-A TYK2 inhibitors, compositions and methods thereof 凌科药业(杭州)有限公司 2024-07-26 CN disclosed