Sugi Predict

Sugi Predict / Compounds / SCHEMBL31107113

SCHEMBL31107113

SCHEMBL31107113

CCCCCCCCCCCCCCC(CCCN)(CCCCCCCCCC)C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DNM1 Q05193 8/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ EPHX1 P07099 1/20 0.46
▸ SMPD1 P17405 2/20 0.46
▸ FDPS P14324 2/20 0.46
▸ CES2 O00748 1/20 0.41

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
Hydrochloric Acid SCHEMBL19924855 0.98 DNM1 (0.48) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL9452883 0.94 SMPD1 (0.47) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL30823938 0.94 SMPD1 (0.47) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL20954037 0.92 FDPS (0.47) SMPD1FDPSCES2
SCHEMBL29180319 0.92 FDPS (0.47) SMPD1FDPSCES2
SCHEMBL10896548 0.92 FDPS (0.47) SMPD1FDPSCES2
SCHEMBL18641723 0.92 FDPS (0.47) SMPD1FDPSCES2
SCHEMBL20510878 0.92 FDPS (0.47) SMPD1FDPSCES2
SCHEMBL31472765 0.92 FDPS (0.47) SMPD1FDPSCES2
SCHEMBL27527657 0.92 FDPS (0.47) SMPD1FDPSCES2

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-118685625-A Method for precisely sorting and reinforcing leaching of waste impermeable materials 中南大学 2024-09-24 — — CN disclosed