SCHEMBL27166298

SCHEMBL27166298

COCCOCCOCCOc1ccc(C[C@@H]2CN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CCN2CC(=O)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.39
KCNA5 P22460 2/20 0.37
KDM4E B2RXH2 2/20 0.37
SIGMAR1 Q99720 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
RECQL P46063 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
RAB9A P51151 1/20 0.36
KCNH2 Q12809 1/20 0.36
LTA4H P09960 1/20 0.36
S1PR1 P21453 2/20 0.36
S1PR5 Q9H228 2/20 0.36

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
SCHEMBL27166234 1.00 FOLH1 (0.39) FOLH1KCNA5KDM4ESIGMAR1MEN1
SCHEMBL27268341 0.94 ALDH1A1 (0.41) FOLH1KCNA5KDM4EMEN1KMT2A
SCHEMBL27166220 0.93 FOLH1 (0.36) FOLH1KCNA5KDM4ESIGMAR1MEN1
SCHEMBL27166228 0.93 FOLH1 (0.36) FOLH1KCNA5KDM4ESIGMAR1MEN1
SCHEMBL27298326 0.92 ALDH1A1 (0.38) KCNA5KDM4ESIGMAR1MEN1KMT2A
SCHEMBL27166241 0.92 KDM4E (0.41) FOLH1KDM4EMEN1KMT2AS1PR1
SCHEMBL27166254 0.92 KDM4E (0.41) FOLH1KDM4EMEN1KMT2AS1PR1
SCHEMBL27268819 0.91 DRD2 (0.36) KCNA5KDM4ESIGMAR1MEN1KMT2A
SCHEMBL30804769 0.91 HRH3 (0.35) FOLH1KCNA5HRH3KCNH2LTA4H
SCHEMBL30804760 0.91 HRH3 (0.35) FOLH1KCNA5HRH3KCNH2LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4584251-A1 NEW CONTRAST AGENTS FOR USE IN DIAGNOSTIC IMAGING Bayer Aktiengesellschaft (DE) 2025-07-16 EP claimed
WO-2024052549-A1 NEW CONTRAST AGENTS FOR USE IN DIAGNOSTIC IMAGING BAYER AKTIENGESELLSCHAFT (DE) 2024-03-14 WO claimed
EP-4584251-A1 NEW CONTRAST AGENTS FOR USE IN DIAGNOSTIC IMAGING Bayer Aktiengesellschaft (DE) 2025-07-16 EP disclosed
WO-2024052549-A1 NEW CONTRAST AGENTS FOR USE IN DIAGNOSTIC IMAGING BAYER AKTIENGESELLSCHAFT (DE) 2024-03-14 WO disclosed
WO-2024052549-A1 NEW CONTRAST AGENTS FOR USE IN DIAGNOSTIC IMAGING BAYER AKTIENGESELLSCHAFT (DE) 2024-03-14 WO disclosed
EP-4335840-A1 NEW CONTRAST AGENTS FOR USE IN DIAGNOSTIC IMAGING Bayer Aktiengesellschaft (DE) 2024-03-13 EP disclosed