SCHEMBL19245191

SCHEMBL19245191

C/C(I)=C/c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.54
TSHR P16473 1/20 0.54
AKR1C3 P42330 1/20 0.54
KDM1A O60341 2/20 0.50
FBP1 P09467 1/20 0.48
RECQL P46063 1/20 0.45
HTT P42858 1/20 0.44
GLA P06280 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
AKR1C1 Q04828 1/20 0.41
ESR1 P03372 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALOX15 P16050 1/20 0.40
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL9153625 1.00 ALDH1A1 (0.54) ALDH1A1TSHRAKR1C3KDM1AFBP1
SCHEMBL6932741 1.00 ALDH1A1 (0.54) ALDH1A1TSHRAKR1C3KDM1AFBP1
Benzene SCHEMBL27597826 0.78 ALDH1A1 (0.58) ALDH1A1TSHRAKR1C3KDM1AFBP1
SCHEMBL60657 0.78 ALDH1A1 (0.58) ALDH1A1TSHRAKR1C3KDM1AFBP1
SCHEMBL8557597 0.78 ALDH1A1 (0.58) ALDH1A1TSHRAKR1C3KDM1AFBP1
SCHEMBL23458002 0.78 AKR1C3 (0.73) ALDH1A1TSHRAKR1C3KDM1AFBP1
SCHEMBL598776 0.78 ALDH1A1 (0.58) ALDH1A1TSHRAKR1C3KDM1AFBP1
SCHEMBL6433811 0.78 AKR1C3 (0.73) ALDH1A1TSHRAKR1C3KDM1AFBP1
SCHEMBL9579647 0.78 ALDH1A1 (0.46) ALDH1A1TSHRAKR1C3KDM1AFBP1
SCHEMBL10719672 0.77 AKR1C3 (0.69) ALDH1A1TSHRAKR1C3FBP1RECQL

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
EP-4306609-A1 LAMINATE, RELEASE AGENT COMPOSITION, AND METHOD FOR MANUFACTURING PROCESSED SEMICONDUCTOR SUBSTRATE Nissan Chemical Corporation (JP) 2024-01-17 EP disclosed
US-9730876-B2 Process for dyeing keratin fibres comprising a dye-pigment, a photoactive compound and a light source L'OREAL (FR) 2017-08-15 US disclosed