SCHEMBL8663087

SCHEMBL8663087

O=C(NC(=O)c1c(F)cccc1Cl)Nc1ccc(-c2ccc(Cl)cc2)cn1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
NPC1 O15118 3/20 0.51
ALDH1A1 P00352 1/20 0.51
PKM P14618 1/20 0.51
TSHR P16473 1/20 0.51
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 3/20 0.49
GAA P10253 1/20 0.48
BRD4 O60885 1/20 0.47
PPIA P62937 1/20 0.46
MAPT P10636 1/20 0.45
DEGS1 O15121 1/20 0.45
JAK2 O60674 1/20 0.45
JAK1 P23458 1/20 0.45
TYK2 P29597 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL11036041 0.94 SMN1; SMN2 (0.54) RAB9ASMN1; SMN2NPC1ALDH1A1PKM
SCHEMBL11012517 0.92 RAB9A (0.55) RAB9ASMN1; SMN2NPC1ALDH1A1PKM
SCHEMBL11096424 0.91 RAB9A (0.61) RAB9ASMN1; SMN2NPC1ALDH1A1PKM
SCHEMBL11015466 0.84 RAB9A (0.55) RAB9ANPC1MAPTDEGS1MEN1
SCHEMBL8656265 0.84 RAB9A (0.49) RAB9ASMN1; SMN2NPC1ALDH1A1PKM
SCHEMBL8659238 0.84 RAB9A (0.65) RAB9ASMN1; SMN2NPC1ALDH1A1PKM
SCHEMBL11099353 0.84 NPC1 (0.50) RAB9ASMN1; SMN2NPC1L3MBTL1GAA
SCHEMBL11171786 0.84 RAB9A (0.48) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL11185414 0.83 IL2 (0.50) NPC1ALDH1A1L3MBTL1GAAPPIA
SCHEMBL11171162 0.82 RAB9A (0.48) RAB9ASMN1; SMN2NPC1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4405552-A INSECTICIDES ELI LILLY AND COMPANY (US) 1983-09-20 US claimed
US-5776981-A Use of acyl urea compounds for controlling endoparasites and ectoparasites of warm-blooded animals NOVARTIS CORPORATION (US) 1998-07-07 US disclosed
US-5776982-A Use of acyl urea compounds for controlling endoparasites and ectoparasites of warm-blooded animals NOVARTIS CORPORATION (US) 1998-07-07 US disclosed
US-5420163-A Insecticides or miticides CIBA-GEIGY (US) 1995-05-30 US disclosed
US-5135953-A Oral or injections; cattle, swine, poultry CIBA-GEIGY (US) 1992-08-04 US disclosed
EP-0211004-A1 USE OF ACYL UREA COMPOUNDS FOR CONTROLLING ENDOPARASITES AND ECTOPARASITES OF WARM-BLOODED ANIMALS RHONE-POULENC NEDERLAND B.V. (NL) 1987-02-25 EP disclosed
WO-1986003941-A1 USE OF ACYL UREA COMPOUNDS FOR CONTROLLING ENDOPARASITES AND ECTOPARASITES OF WARM-BLOODED ANIMALS UNION CARBIDE CORPORATION (US) 1986-07-17 WO disclosed