SCHEMBL23974072

SCHEMBL23974072

CC(C)C(=O)OCc1ccc(NC(=O)COCC(=O)NCCOCCOCCOCCOCCOCCn2cc(C(C)C)nn2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 1/20 0.41
▸ MAPK1 P28482 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ TSHR P16473 1/20 0.35
▸ KIT P10721 1/20 0.35
▸ PDGFRA P16234 1/20 0.35
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ CA12 O43570 2/20 0.33
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ CA4 P22748 2/20 0.33
▸ CA9 Q16790 2/20 0.33

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
SCHEMBL22299956 0.91 FOLH1 (0.38) FOLH1MAPK1MEN1KMT2ATSHR
SCHEMBL24491154 0.79 FOLH1 (0.38) FOLH1MAPK1MAPTCA12CA1
SCHEMBL23974075 0.77 FOLH1 (0.35) FOLH1CA2OPRM1F2RL1
SCHEMBL24491200 0.77 FOLH1 (0.36) FOLH1MAPK1KMT2ANPC1RAB9A
SCHEMBL23974353 0.76 FOLH1 (0.43) FOLH1MAPK1NPC1RAB9AALDH1A1
SCHEMBL22299551 0.76 FOLH1 (0.39) FOLH1CA12CA1CA2CA9
SCHEMBL24451215 0.76 DGAT1 (0.34) FOLH1
SCHEMBL26770669 0.73 MTNR1A (0.37) FOLH1MAPK1MEN1KMT2ATSHR
SCHEMBL22541244 0.73 FOLH1 (0.34) FOLH1KITPDGFRAOPRM1OPRD1
SCHEMBL26032229 0.71 GLP1R (0.39) OPRM1

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
EP-3903825-A1 BI-LIGAND DRUG CONJUGATE AND USE THEREOF Coherent Biopharma (Suzhou), Limited (CN) 2021-11-03 — — EP disclosed
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