SCHEMBL24285671

SCHEMBL24285671

CS/C(=C/C#N)c1ccc(C)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRB2 P47870 1/20 0.38
ALDH1A1 P00352 10/20 0.36
LMNA P02545 5/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
TDP1 Q9NUW8 3/20 0.36
PKM P14618 2/20 0.36
HTT P42858 2/20 0.36
ATM Q13315 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
HPGD P15428 2/20 0.36
NLRP1 Q9C000 1/20 0.36
NTSR1 P30989 1/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
CYP2A6 P11509 1/20 0.35

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
SCHEMBL24855400 0.83 RECQL (0.38) GABRA1GABRG2GABRB3GABRB2ALDH1A1
SCHEMBL26552016 0.81 HPGD (0.42) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL25996320 0.79 ALDH1A1 (0.35) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL14189755 0.75 PDE4A (0.55) GABRA1GABRG2GABRB3GABRB2ALDH1A1
SCHEMBL26000700 0.74 ALDH1A1 (0.38) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL24340773 0.74 HDAC3 (0.47) SMN1; SMN2MEN1KMT2AHDAC3HDAC4
SCHEMBL625934 0.74 GABRA1 (0.53) GABRA1GABRG2GABRB3GABRB2ALDH1A1
SCHEMBL625933 0.74 GABRA1 (0.53) GABRA1GABRG2GABRB3GABRB2ALDH1A1
SCHEMBL625935 0.74 GABRA1 (0.53) GABRA1GABRG2GABRB3GABRB2ALDH1A1
SCHEMBL24398879 0.72 GABRA1 (0.40) GABRA1GABRG2GABRB3GABRB2ALDH1A1

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
EP-4218825-A1 CONJUGATE OF FUNCTIONAL POLYPEPTIDE VARIANT, AND USE THEREOF Proabtech Inc. (KR) 2023-08-02 EP disclosed
WO-2023068736-A1 ARGININE DECARBOXYLASE VARIANT AND FUNCTIONAL POLYPEPTIDE VARIANT-ALBUMIN CONJUGATE PREPARED USING SAME 주식회사 프로앱텍 2023-04-27 WO disclosed
WO-2022065936-A1 CONJUGATE OF FUNCTIONAL POLYPEPTIDE VARIANT, AND USE THEREOF 주식회사 프로앱텍 2022-03-31 WO disclosed