SCHEMBL8424311

SCHEMBL8424311

CC(C)(C)N=C(c1ccccc1)P(C1CCCCC1)C1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 2/20 0.34
ALOX12 P18054 1/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
ALDH1A1 P00352 2/20 0.32
RECQL P46063 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GAA P10253 1/20 0.32
NPC1 O15118 1/20 0.31
MCL1 Q07820 1/20 0.31
OPRK1 P41145 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
SCN1A P35498 1/20 0.31
SCN2A Q99250 1/20 0.31
SCN3A Q9NY46 1/20 0.31
POLB P06746 1/20 0.31
ELANE P08246 1/20 0.31

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
SCHEMBL7034476 0.82 KDM1A (0.30)
SCHEMBL8419261 0.78 MEN1 (0.39) RAB9ASMN1; SMN2LMNAALOX12MEN1
SCHEMBL10298156 0.72 MEN1 (0.41) RAB9ASMN1; SMN2LMNAALOX12MEN1
SCHEMBL20027251 0.72 RAB9A (0.44) RAB9ASMN1; SMN2LMNAALOX12KMT2A
SCHEMBL377393 0.70 RAB9A (0.37) RAB9ASMN1; SMN2LMNAALOX12ALDH1A1
SCHEMBL20027364 0.70 NPC1 (0.46) RAB9ASMN1; SMN2LMNAALOX12MEN1
SCHEMBL27714879 0.69 RAB9A (0.39) RAB9ASMN1; SMN2LMNAALOX12MEN1
SCHEMBL20955841 0.69 MCL1 (0.43) RAB9ASMN1; SMN2ALDH1A1GAANPC1
SCHEMBL6937935 0.68 MCL1 (0.35) RAB9ASMN1; SMN2LMNAALOX12ALDH1A1
SCHEMBL15364449 0.68 ESR1 (0.36) RAB9ASMN1; SMN2LMNAALOX12MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944666-A1 CATALYST SYSTEMS FOR PRODUCING COPOLYMERS OF CARBON MONOXIDE AND OLEFINICALLY UNSATURATED COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 1999-09-29 EP disclosed
WO-1998025991-A1 CATALYST SYSTEMS FOR PRODUCING COPOLYMERS OF CARBON MONOXIDE AND OLEFINICALLY UNSATURATED COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 1998-06-18 WO disclosed