SCHEMBL29638353

SCHEMBL29638353

CSc1cccc(N=C=O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.43
TRPA1 O75762 1/20 0.43
MAPK1 P28482 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPT P10636 3/20 0.38
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
SIGMAR1 Q99720 2/20 0.37
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 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
SCHEMBL125319 1.00 CYP3A4 (0.43) CYP3A4TRPA1MAPK1TDP1MEN1
SCHEMBL8937136 0.84 MAPK1 (0.44) CYP3A4TRPA1MAPK1TDP1POLB
SCHEMBL9315146 0.84 MAPK1 (0.44) CYP3A4TRPA1MAPK1TDP1MAPT
SCHEMBL31134964 0.84 MAPK1 (0.44) CYP3A4TRPA1MAPK1TDP1POLB
SCHEMBL1457560 0.81 MIF (0.48) CYP3A4MAPK1TDP1MEN1KMT2A
SCHEMBL28080748 0.81 MAPK1 (0.41) CYP3A4TRPA1MAPK1TDP1GABRA1
SCHEMBL2651634 0.80 GABRA1 (0.42) CYP3A4TRPA1MAPK1TDP1GABRA1
SCHEMBL7529742 0.80 CYP4F2 (0.42) TDP1KMT2AMAPTTP53POLB
SCHEMBL11718768 0.79 CYP3A4 (0.46) CYP3A4TRPA1MAPK1TDP1MEN1
SCHEMBL28087260 0.79 MAPK1 (0.40) CYP3A4TRPA1MAPK1TDP1GABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4244204-A1 SUBSTITUTED MONO- AND POLY-PHENYL-CORE MONOMERS AND POLYMERS THEREOF FOR VOLUME BRAGG GRATINGS META PLATFORMS TECHNOLOGIES, LLC (US) 2023-09-20 EP disclosed
EP-4244203-A1 SUBSTITUTED PROPANE-CORE MONOMERS AND POLYMERS THEREOF FOR VOLUME BRAGG GRATINGS META PLATFORMS TECHNOLOGIES, LLC (US) 2023-09-20 EP disclosed
CN-116568669-A Substituted mono-and poly-benzene nuclear monomers and polymers thereof for volume Bragg gratings 元平台技术有限公司 2023-08-08 CN disclosed
CN-116457336-A Substituted propane nuclear monomer for volume Bragg grating and polymer thereof 元平台技术有限公司 2023-07-18 CN disclosed
EP-4065548-A1 AROMATIC SUBSTITUTED ALKANE-CORE MONOMERS AND POLYMERS THEREOF FOR VOLUME BRAGG GRATINGS Facebook Technologies, LLC (US) 2022-10-05 EP disclosed
CN-114728889-A Aromatic substituted alkane-nuclear monomers and polymers thereof for volume bragg gratings 脸谱科技有限责任公司 2022-07-08 CN disclosed
WO-2022104113-A1 SUBSTITUTED MONO- AND POLY-PHENYL-CORE MONOMERS AND POLYMERS THEREOF FOR VOLUME BRAGG GRATINGS FACEBOOK TECHNOLOGIES, LLC (US) 2022-05-19 WO disclosed
WO-2022104137-A1 SUBSTITUTED PROPANE-CORE MONOMERS AND POLYMERS THEREOF FOR VOLUME BRAGG GRATINGS FACEBOOK TECHNOLOGIES, LLC (US) 2022-05-19 WO disclosed