SCHEMBL1377069

SCHEMBL1377069

CCCCOCCC(=O)N(C)CCC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
ALDH1A1 P00352 2/20 0.41
EPHX2 P34913 2/20 0.40
CNR1 P21554 1/20 0.40
DNM1 Q05193 1/20 0.39
CYP3A4 P08684 1/20 0.37
CES2 O00748 1/20 0.36
THRB P10828 2/20 0.35
THRA P10827 1/20 0.35
ATM Q13315 1/20 0.34
MEN1 O00255 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.34
RARB P10826 1/20 0.33

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
SCHEMBL1373151 0.95 CES2 (0.43) TSHRALDH1A1EPHX2CNR1DNM1
SCHEMBL1373191 0.93 CES2 (0.46) ALDH1A1EPHX2CNR1DNM1CES2
SCHEMBL1373915 0.89 NR1I2 (0.36) ALDH1A1EPHX2CNR1DNM1THRA
SCHEMBL16355252 0.88 THRA (0.38) TSHRALDH1A1EPHX2CNR1DNM1
SCHEMBL1376669 0.87 TSHR (0.43) TSHRALDH1A1EPHX2DNM1CYP3A4
SCHEMBL1373497 0.86 ALDH1A1 (0.39) TSHRALDH1A1EPHX2CNR1DNM1
SCHEMBL18843361 0.85 TSHR (0.42) TSHRALDH1A1EPHX2DNM1CYP3A4
SCHEMBL30976521 0.85 EPHX2 (0.54) ALDH1A1EPHX2CNR1DNM1CES2
SCHEMBL1376984 0.83 ALDH1A1 (0.50) TSHRALDH1A1CYP3A4CES2
SCHEMBL102640 0.82 ALDH1A1 (0.61) TSHRALDH1A1DNM1CYP3A4CES2

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-8563495-B2 Resist remover composition and method for removing resist using same IDEMITSU KOSAN CO., LTD. (JP) 2013-10-22 US disclosed
US-20110287995-A1 RESIST REMOVER COMPOSITION AND METHOD FOR REMOVING RESIST USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2011-11-24 US disclosed