SCHEMBL27584640

SCHEMBL27584640

CCC(=O)CC.Fc1[nH]nnc1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 1/20 0.40
▸ BRD4 O60885 1/20 0.40
▸ CREBBP Q92793 1/20 0.40
▸ RAB9A P51151 2/20 0.38
▸ ADORA3 P0DMS8 2/20 0.37
▸ ADORA2A P29274 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ GSK3A P49840 2/20 0.36
▸ GSK3B P49841 2/20 0.36
▸ DHODH Q02127 1/20 0.35
▸ LMNA P02545 2/20 0.35
▸ HSD11B1 P28845 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ TP53 P04637 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ CHEK1 O14757 1/20 0.34

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
SCHEMBL20605668 0.83 ALOX15 (0.43) RAB9AADORA2ASMN1; SMN2MAPTLMNA
Biphenyl SCHEMBL22163814 0.72 MAPT (0.61) SMN1; SMN2MAPTL3MBTL1GSK3BLMNA
SCHEMBL27861076 0.70 MEN1 (0.42) RAB9ASMN1; SMN2MAPTLMNAKDM4E
SCHEMBL15947000 0.69 RAB9A (0.45) HPGDSBRD4CREBBPRAB9ASMN1; SMN2
SCHEMBL7672968 0.69 RAB9A (0.45) HPGDSRAB9ASMN1; SMN2DHODHLMNA
SCHEMBL9985730 0.69 HPGDS (0.61) HPGDSRAB9AADORA3SMN1; SMN2MAPT
Fluorobenzene SCHEMBL27296705 0.68 HSD11B1 (0.48) RAB9ASMN1; SMN2MAPTL3MBTL1HSD11B1
SCHEMBL15946998 0.68 KDM4E (0.46) HPGDSRAB9ALMNAKDM4EHPGD
SCHEMBL14498353 0.68 PTGS1 (0.40) HPGDSBRD4RAB9ASMN1; SMN2MAPT
SCHEMBL27872988 0.68 KDM4E (0.45) SMN1; SMN2MAPTLMNAKDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101099460-A Method of microencapsulating an agricultural active having a high melting point and uses for such materials MONSANTO TECHNOLOGY LLC (US) 2008-01-09 — — CN disclosed
CN-100337541-C Method for microencapsulating agrochemical active substances having a high melting point and use of these substances MONSANTO TECHNOLOGY LLC (US) 2007-09-19 — — CN disclosed
CN-1501771-A Method for microencapsulating agrochemical active substances having a high melting point and use of these substances ������ɽ���� 2004-06-02 — — CN disclosed
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