SCHEMBL29601807

SCHEMBL29601807

C[Hf+2]C.Cc1cc(-c2ccccc2)c([O-])c(-c2ccccc2-c2csc(-c3nc(-c4ccccc4-c4cc(C)cc(-c5ccccc5)c4[O-])cs3)n2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SREBF2 Q12772 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.44
RAB9A P51151 3/20 0.44
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
MAPT P10636 5/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
NPC1 O15118 2/20 0.41
PLAU P00749 1/20 0.41
C1S P09871 1/20 0.41
KMT2A Q03164 7/20 0.41
MEN1 O00255 5/20 0.41
KDM4E B2RXH2 4/20 0.40
AR P10275 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL29601274 0.93 SREBF2 (0.45) SREBF2SMN1; SMN2RAB9ACASP3SENP8
SCHEMBL29601262 0.81 SMN1; SMN2 (0.54) SREBF2SMN1; SMN2RAB9ACASP3SENP8
SCHEMBL29601797 0.78 KMT2A (0.36) SREBF2SMN1; SMN2RAB9ACASP3SENP8
SCHEMBL22320128 0.78 SMN1; SMN2 (0.54) SREBF2SMN1; SMN2RAB9ACASP3SENP8
SCHEMBL30388055 0.73 SREBF2 (0.51) SREBF2SMN1; SMN2RAB9ACASP3SENP8
SCHEMBL29602175 0.71 RAB9A (0.34) SREBF2SMN1; SMN2RAB9ACASP3SENP8
SCHEMBL11213832 0.71 RAB9A (0.77) SREBF2SMN1; SMN2RAB9ACASP3SENP8
SCHEMBL11461511 0.69 SREBF2 (0.65) SREBF2SMN1; SMN2RAB9ACASP3SENP8
SCHEMBL11533708 0.68 RAB9A (0.66) SREBF2SMN1; SMN2RAB9ACASP3SENP8
SCHEMBL11765529 0.67 RAB9A (0.58) SREBF2SMN1; SMN2RAB9ACASP3SENP8

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-4232484-A1 MULTIDENTATE LEWIS BASE CATALYSTS AND METHODS FOR USE THEREOF ExxonMobil Chemical Patents Inc. (US) 2023-08-30 EP disclosed
WO-2022087121-A1 MULTIDENTATE LEWIS BASE CATALYSTS AND METHODS FOR USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2022-04-28 WO disclosed