Sugi Predict

Sugi Predict / Compounds / Formic Acid

Formic Acid

Formic Acid

SCHEMBL23536757

CN(C)S(=O)(=O)c1ccc(S(=O)(=O)n2nc(N3CCC4(CC3)C[N+](C)(C)c3cc(F)ccc34)c3ccccc32)cc1.O=C[O-]

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HTR6 P50406 2/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30

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
SCHEMBL23536524 0.82 SMN1; SMN2 (0.36) LMNATP53GAAHTTSMN1; SMN2
SCHEMBL23536619 0.78 TP53 (0.34) LMNATP53GAAHTTSMN1; SMN2
SCHEMBL23536667 0.78 LMNA (0.34) LMNATP53GAAHTTSMN1; SMN2
SCHEMBL23536585 0.78 LMNA (0.34) LMNATP53GAAHTTSMN1; SMN2
SCHEMBL23536772 0.75 LMNA (0.39) LMNATP53SMN1; SMN2CYP3A4
SCHEMBL23536596 0.74 SLC6A2 (0.39) LMNATP53GAAHTTSMN1; SMN2
SCHEMBL23536839 0.74 HSD17B10 (0.39) LMNASMN1; SMN2HTR6CYP3A4CYP2D6
SCHEMBL23536661 0.74 SMN1; SMN2 (0.46) LMNATP53GAAHTTSMN1; SMN2
SCHEMBL23536666 0.73 GPR119 (0.34) SMN1; SMN2HTR6CYP3A4CYP2D6
SCHEMBL23536635 0.72 HSD17B10 (0.48) LMNAGAAHTTHTR6

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
WO-2021127333-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 — — WO disclosed