SCHEMBL9326850

SCHEMBL9326850

C=CCON(C)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
CYP3A4 P08684 1/20 0.36
ALOX15 P16050 1/20 0.35
HTT P42858 2/20 0.34
ALDH1A1 P00352 2/20 0.34
TSHR P16473 1/20 0.33
POLB P06746 1/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA4 P43681 1/20 0.32
ESR1 P03372 1/20 0.32
PKM P14618 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL24045852 0.81 KDM4E (0.35) MEN1KMT2AHTTALDH1A1TSHR
SCHEMBL9634451 0.79 CYP3A4 (0.38) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL8421910 0.79 CYP3A4 (0.38) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL9320965 0.74 MEN1 (0.39) MEN1KMT2AHTTALDH1A1TSHR
SCHEMBL29113994 0.72 TSHR (0.49) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL29093371 0.72 GAA (0.39) MEN1KMT2AALOX15HTTALDH1A1
SCHEMBL21484985 0.71 TSHR (0.46) HTTALDH1A1TSHRSMN1; SMN2
SCHEMBL5892065 0.71 MEN1 (0.38) MEN1KMT2AHTTALDH1A1TSHR
SCHEMBL28084405 0.69 ALDH1A1 (0.37) MEN1KMT2ACYP3A4HTTALDH1A1
SCHEMBL88871 0.69 CHRNB2 (0.54) MEN1KMT2ACYP3A4ALDH1A1TSHR

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
WO-2023073711-A1 COLLAGEN-CONTAINING CURABLE FORMULATIONS COLLPLANT LTD. (IL) 2023-05-04 WO disclosed
US-5308735-A Aromatic-aldehyde resins, improved solubility NIPPON PAINT CO., LTD. (JP) 1994-05-03 US disclosed
EP-0540016-A1 Photosensitive resin and resin composition for lithographic printing Nippon Paint Co., Ltd. (JP) 1993-05-05 EP disclosed