SCHEMBL17722397

SCHEMBL17722397

CCCCCCCCOc1ccc2cc(N)ccc2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.68
NR5A1 Q13285 1/20 0.51
THRA P10827 1/20 0.50
HTR1A P08908 5/20 0.48
HTR1D P28221 5/20 0.48
HTR1B P28222 5/20 0.48
MAPT P10636 3/20 0.48
TP53 P04637 3/20 0.48
MAPK1 P28482 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
HTR2A P28223 1/20 0.48
CYP2C19 P33261 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL6762208 1.00 TSHR (0.68) TSHRNR5A1THRAHTR1AHTR1D
SCHEMBL295119 1.00 TSHR (0.68) TSHRNR5A1THRAHTR1AHTR1D
SCHEMBL24168626 0.95 TSHR (0.59) TSHRMAPTTP53MAPK1TDP1
SCHEMBL31413515 0.89 TSHR (0.50) TSHRMAPTMAPK1TDP1KDM4E
SCHEMBL4945033 0.89 NR5A1 (0.62) TSHRNR5A1THRATP53CA12
SCHEMBL10642885 0.89 NR5A1 (0.62) TSHRNR5A1THRATP53CA12
SCHEMBL347683 0.89 NR5A1 (0.62) TSHRNR5A1THRATP53CA12
SCHEMBL1114857 0.87 MAPT (0.53) TSHRHTR1AHTR1BMAPTTP53
SCHEMBL17162145 0.85 NR5A1 (0.58) TSHRNR5A1THRATP53MAPK1
SCHEMBL17018215 0.85 NR5A1 (0.58) TSHRNR5A1THRATP53MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9335442-B1 Polarizing film and display device including the polarizing film SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-05-10 US disclosed