SCHEMBL27501736

SCHEMBL27501736

CCC1(c2ccccc2)C=CC=CC1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 1/20 0.32
OPRM1 P35372 1/20 0.31
OPRK1 P41145 1/20 0.31
OPRL1 P41146 1/20 0.31
MAOA P21397 4/20 0.31
MAOB P27338 4/20 0.31
TAAR1 Q96RJ0 1/20 0.31
CYP2C19 P33261 1/20 0.30
KDM1A O60341 3/20 0.30
HDAC4 P56524 1/20 0.30

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
Ethane SCHEMBL27995166 0.98 MEN1 (0.34) TSHRMEN1CYP1A2POLBAPEX1
Methylamine SCHEMBL28201991 0.96 MEN1 (0.33) TSHRMEN1CYP1A2POLBAPEX1
SCHEMBL28237893 0.86 OPRM1 (0.33) TSHRMEN1CYP1A2POLBAPEX1
SCHEMBL28146070 0.82
Methylamine SCHEMBL42507 0.82 MAOB (0.40) MAOAMAOBTAAR1
SCHEMBL28463701 0.82 SLC6A4 (0.35) MAOAMAOBKDM1A
SCHEMBL29173302 0.82 CYP19A1 (0.36)
SCHEMBL28486650 0.82 TSHR (0.32) TSHRTDP1OPRM1OPRK1OPRL1
SCHEMBL28161702 0.82 ESR1 (0.33) TSHRMEN1CYP1A2KMT2ALMNA
SCHEMBL7453568 0.81 GAA (0.34) TSHROPRM1OPRL1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116829366-A On-press development type lithographic printing plate precursor, method for producing lithographic printing plate, lithographic printing method, and color former 富士胶片株式会社 2023-09-29 CN disclosed
CN-116723942-A On-press development type lithographic printing plate precursor, method for producing lithographic printing plate, and lithographic printing method 富士胶片株式会社 2023-09-08 CN disclosed
CN-106496539-B A kind of hyperbranched nonionic surfactant and its preparation method and application 华东师范大学 2019-01-18 CN disclosed
CN-1037092-C Process for synthesis of (methylbeneyl) xylene oligomers and their application as dielectric ATOCHEM (FR) 1998-01-21 CN disclosed
CN-1064672-A The synthetic method of xylyl xylene oligomers and as dielectric application ATOCHEM (FR) 1992-09-23 CN disclosed