SCHEMBL14402764

SCHEMBL14402764

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)CCSC(C(=O)NCCOCCOCCNC(=O)c1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c(C(=O)O)c1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.50
▸ ALB P02768 1/20 0.45
▸ ESR1 P03372 1/20 0.45
▸ HTRA2 O43464 4/20 0.44
▸ HTRA1 Q92743 4/20 0.44
▸ BTK Q06187 1/20 0.44
▸ SLC5A2 P31639 2/20 0.43
▸ HTR3A P46098 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
SCHEMBL14402762 0.95 ALB (0.49) FOLH1ALBESR1HTRA2HTRA1
SCHEMBL14402763 0.92 FOLH1 (0.48) FOLH1ALBESR1HTRA2HTRA1
SCHEMBL14402543 0.92 FOLH1 (0.48) FOLH1ALBESR1HTRA2HTRA1
SCHEMBL14402535 0.91 ALB (0.50) FOLH1ALBESR1HTRA2HTRA1
SCHEMBL14402542 0.86 CA9 (0.47) —
SCHEMBL9906265 0.84 FOLH1 (0.51) FOLH1ALBESR1HTRA2HTRA1
SCHEMBL1688103 0.83 FOLH1 (0.55) FOLH1ALBESR1HTRA2HTRA1
SCHEMBL16561810 0.81 FOLH1 (0.62) FOLH1ALBESR1BTKSLC5A2
SCHEMBL9906147 0.79 FOLH1 (0.46) FOLH1ALBESR1HTRA2HTRA1
SCHEMBL17346851 0.79 FOLH1 (0.60) FOLH1ALBESR1BTKSLC5A2

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
US-7279585-B2 Lipophilic electrophoretic probes MONOGRAM BIOSCIENCES, INC. (US) 2007-10-09 — — US disclosed
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