SCHEMBL11233207

SCHEMBL11233207

CCCCCCC(Oc1ccc(NC(=O)NC(=O)c2ccccc2Cl)cc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.52
▸ PYGL P06737 1/20 0.48
▸ GCGR P47871 1/20 0.48
▸ RAB9A P51151 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ SMO Q99835 1/20 0.43
▸ PCTP Q9UKL6 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ HPGD P15428 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
SCHEMBL11239414 0.92 TDP1 (0.55) TDP1PYGLGCGRRAB9AALDH1A1
SCHEMBL11235108 0.90 TDP1 (0.40) TDP1
SCHEMBL11236831 0.89 FFAR1 (0.48) RAB9AALDH1A1NPC1LMNA
SCHEMBL11234781 0.88 TDP1 (0.57) TDP1PYGLGCGRRAB9AALDH1A1
SCHEMBL11241073 0.86 TDP1 (0.55) TDP1GCGRRAB9AALDH1A1NPC1
SCHEMBL11243575 0.83 FAAH (0.42) —
SCHEMBL396610 0.80 TDP1 (0.61) TDP1PYGLGCGRRAB9AALDH1A1
SCHEMBL11244515 0.80 TDP1 (0.63) TDP1PYGLGCGRRAB9AALDH1A1
SCHEMBL11243840 0.79 TDP1 (0.58) TDP1PYGLGCGRRAB9AALDH1A1
SCHEMBL11244568 0.79 TDP1 (0.58) TDP1PYGLGCGRRAB9AALDH1A1

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
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