SCHEMBL11249058

SCHEMBL11249058

CC(O)C(Oc1ccc(NC(=O)NC(=O)c2ccccc2Cl)cc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.57
▸ GCGR P47871 1/20 0.53
▸ RAB9A P51151 5/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ NPC1 O15118 4/20 0.48
▸ POLB P06746 2/20 0.48
▸ PKM P14618 1/20 0.48
▸ SMO Q99835 3/20 0.48
▸ PYGL P06737 4/20 0.46
▸ PCTP Q9UKL6 1/20 0.45
▸ PLCG2 P16885 1/20 0.43
▸ NPY5R Q15761 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ GHSR Q92847 1/20 0.42

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
SCHEMBL11244568 0.92 TDP1 (0.58) TDP1GCGRRAB9AALDH1A1NPC1
SCHEMBL11234149 0.89 TDP1 (0.60) TDP1GCGRRAB9AALDH1A1NPC1
SCHEMBL11240579 0.88 NPC1 (0.49) TDP1RAB9AALDH1A1NPC1NPY5R
SCHEMBL396610 0.88 TDP1 (0.61) TDP1GCGRRAB9AALDH1A1NPC1
SCHEMBL11244515 0.85 TDP1 (0.63) TDP1GCGRRAB9AALDH1A1NPC1
SCHEMBL11136952 0.85 TDP1 (0.66) TDP1GCGRRAB9AALDH1A1NPC1
SCHEMBL11243840 0.83 TDP1 (0.58) TDP1GCGRRAB9AALDH1A1NPC1
SCHEMBL11390067 0.83 TDP1 (0.58) TDP1GCGRRAB9AALDH1A1NPC1
SCHEMBL11234781 0.83 TDP1 (0.57) TDP1GCGRRAB9AALDH1A1NPC1
SCHEMBL11245486 0.81 TDP1 (0.61) TDP1GCGRRAB9AALDH1A1NPC1

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-4350706-A MITICIDES, LARVICIDES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1982-09-21 — — US disclosed
Send feedback