SCHEMBL29467632

SCHEMBL29467632

O=C(CCOCCOCCOCCOCCNC(=O)CCOCCOCCOCCOCCNC(=O)C(NC(=O)OCc1ccccc1)C(NC(=O)OCc1ccccc1)C(=O)NCCCC(=O)Oc1c(F)c(F)c(F)c(F)c1F)NCCOCCOCCOCCOCCC(=O)OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 1/20 0.45
▸ CAPN2 P17655 1/20 0.45
▸ LMNA P02545 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ SIRT2 Q8IXJ6 3/20 0.41
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ CTSL P07711 2/20 0.40
▸ CTSS P25774 2/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ CYP2D6 P10635 2/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ SIRT1 Q96EB6 1/20 0.40
▸ HTT P42858 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA5A P35218 1/20 0.39
▸ CTSB P07858 1/20 0.39
▸ EPOR P19235 2/20 0.39

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
SCHEMBL30407627 0.97 SMN1; SMN2 (0.46) CAPN1CAPN2LMNASMN1; SMN2MEN1
SCHEMBL29467710 0.90 SMN1; SMN2 (0.46) CAPN1CAPN2LMNASMN1; SMN2SIRT2
SCHEMBL29467716 0.88 HTT (0.53) CAPN1CAPN2LMNASMN1; SMN2SIRT2
SCHEMBL29467718 0.87 CAPN1 (0.47) CAPN1CAPN2LMNASMN1; SMN2SIRT2
SCHEMBL27438957 0.86 LMNA (0.47) LMNASMN1; SMN2MEN1KMT2ACYP3A4
SCHEMBL27438917 0.86 LMNA (0.47) LMNASMN1; SMN2MEN1KMT2ACYP3A4
SCHEMBL20577215 0.84 LMNA (0.47) LMNASMN1; SMN2MEN1KMT2ACYP3A4
SCHEMBL30407736 0.84 HTT (0.57) CAPN1CAPN2LMNASMN1; SMN2MEN1
SCHEMBL30407162 0.83 SMN1; SMN2 (0.47) CAPN1CAPN2LMNASMN1; SMN2MEN1
SCHEMBL25331392 0.81 SMN1; SMN2 (0.49) CAPN1CAPN2LMNASMN1; SMN2SIRT2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4426727-A2 SPECIFIC CONJUGATION OF AN ANTIBODY Hangzhou Dac Biotech Co., Ltd. (CN) 2024-09-11 — — EP disclosed
WO-2022078524-A4 SPECIFIC CONJUGATION OF AN ANTIBODY HANGZHOU DAC BIOTECH CO., LTD. (CN) 2022-12-08 — — WO disclosed
WO-2022078524-A2 SPECIFIC CONJUGATION OF AN ANTIBODY HANGZHOU DAC BIOTECH CO., LTD. (CN) 2022-04-21 — — WO disclosed
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