SCHEMBL9103024

SCHEMBL9103024

C=Cc1ccc(-c2cc(C=C)ccc2C=C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 2/20 0.34
TP53 P04637 1/20 0.34
PELI1 Q96FA3 2/20 0.34
TRPA1 O75762 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
HDAC8 Q9BY41 1/20 0.32
ESRRB O95718 1/20 0.32
ESR1 P03372 1/20 0.32
ESRRA P11474 1/20 0.32
ESR2 Q92731 1/20 0.32
TYMS P04818 1/20 0.31
DAPK3 O43293 1/20 0.30
JAK2 O60674 1/20 0.30
ABL1 P00519 1/20 0.30
NTRK1 P04629 1/20 0.30
FYN P06241 1/20 0.30
CSF1R P07333 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
SCHEMBL9014009 0.88 TP53 (0.42) ALDH1A1TDP1TP53PELI1TRPA1
SCHEMBL7569813 0.88 ALDH1A1 (0.44) ALDH1A1TSHRTDP1TP53PELI1
SCHEMBL27754545 0.84 ALDH1A1 (0.36) ALDH1A1MAPTTYMSFGFR1GSK3B
Styrene SCHEMBL9476487 0.79 ALDH1A1 (0.56) ALDH1A1TSHRTDP1TP53PELI1
SCHEMBL585316 0.78 ALDH1A1 (0.48) ALDH1A1TSHRTDP1HDAC8DAPK3
SCHEMBL17628515 0.77 ALDH1A1 (0.58) ALDH1A1TSHRTDP1TP53TRPA1
SCHEMBL258183 0.74 ALDH1A1 (0.53) ALDH1A1TSHRTDP1TP53TRPA1
SCHEMBL29415624 0.74 ALDH1A1 (0.53) ALDH1A1TSHRTDP1TP53TRPA1
SCHEMBL593791 0.72 ALDH1A1 (0.79) ALDH1A1TSHRTDP1TP53TRPA1
SCHEMBL583978 0.72 ALDH1A1 (0.79) ALDH1A1TSHRTDP1TP53TRPA1

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
US-5496684-A IMAGE WISE EXPOSURE TO ACTINIC RADIATION FOR LIGHT SENSITIVE ELEMENT SUPPORTS, REMOVAL OF LAYER WITH SOLVENT FOR PLATES AND DEVELOPMENT OF CROSSLINKING AGENT CHASE ELASTOMER CORPORATION (US) 1996-03-05 US disclosed
WO-1995008136-A1 PHOTOSENSITIVE COMPOSITIONS AND ELEMENTS FOR FLEXOGRAPHIC PRINTING CHASE ELASTOMER CORPORATION (US) 1995-03-23 WO disclosed