SCHEMBL9788342

SCHEMBL9788342

CC1(C(=O)NCC(=O)NCCc2ccccc2Cl)CC1(Cl)Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
HIF1A Q16665 2/20 0.45
CNR1 P21554 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
HPGD P15428 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
TSHR P16473 1/20 0.42
PLAAT3 P53816 2/20 0.42
PLAAT5 Q96KN8 2/20 0.42
PLAAT2 Q9NWW9 2/20 0.42
PLAAT4 Q9UL19 2/20 0.42
NPC1 O15118 1/20 0.41
GPR139 Q6DWJ6 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
SCHEMBL9788335 0.84 TAAR1 (0.47) SMN1; SMN2HPGDNPSR1GAATAAR1
SCHEMBL9788362 0.78 TAOK1 (0.51) RAB9AKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL14241832 0.74 HIF1A (0.57) RAB9AHIF1ACNR1SMN1; SMN2HPGD
SCHEMBL27680999 0.74 HIF1A (0.60) RAB9AHIF1ACNR1SMN1; SMN2HPGD
SCHEMBL9425562 0.71 HIF1A (0.57) RAB9AHIF1ACNR1SMN1; SMN2HPGD
SCHEMBL1010214 0.71 MTNR1A (0.61) RAB9AKMT2AMEN1HIF1ACNR1
SCHEMBL1180411 0.69 HIF1A (0.67) RAB9AHIF1ACNR1SMN1; SMN2HPGD
SCHEMBL5592433 0.68 HIF1A (0.57) RAB9AHIF1ACNR1TAAR1PLAAT3
SCHEMBL17442696 0.68 HIF1A (0.57) RAB9AHIF1ACNR1TAAR1PLAAT3
SCHEMBL9788344 0.68 KDM4E (0.46) RAB9ASMN1; SMN2HPGDNPSR1ALDH1A1

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-5034408-A Fungicides of dihalocyclopropanoylamino acid amides BAYER AKTIENGESELLSCHAFT (DE) 1991-07-23 US claimed