O-Tolylamine

O-Tolylamine

SCHEMBL5161740

Cc1ccccc1N.O=S(=O)(O)C(F)(F)F

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.56
TDP1 Q9NUW8 1/20 0.56
CD44 P16070 1/20 0.39
GAA P10253 1/20 0.38
HSD11B1 P28845 1/20 0.37
ALOX15 P16050 2/20 0.37
TSHR P16473 2/20 0.37
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA5A P35218 2/20 0.36
CA9 Q16790 2/20 0.36
CA12 O43570 1/20 0.36
CYP2C9 P11712 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
ALDH1A1 P00352 3/20 0.35
TTR P02766 1/20 0.35

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
O-Xylene SCHEMBL2990079 0.86 ACHE (0.48) HSD11B1TSHRCA1CA2CA5A
O-Tolylamine SCHEMBL4577784 0.86 CYP3A4 (0.68) CYP3A4TDP1CD44GAAALOX15
Trifluoromethanesulfonic Acid SCHEMBL1005216 0.85 TRPA1 (0.45) CYP3A4TDP1CD44HSD11B1TSHR
O-Xylene SCHEMBL27876773 0.84 ACHE (0.46) HSD11B1TSHRCA1CA2CA5A
O-Tolylamine SCHEMBL27656306 0.84 CYP3A4 (0.65) CYP3A4TDP1CD44GAAALOX15
O-Tolylamine SCHEMBL30505312 0.84 CYP3A4 (0.65) CYP3A4TDP1CD44GAAALOX15
O-Tolylamine SCHEMBL4537950 0.84 CYP3A4 (0.65) CYP3A4TDP1CD44GAAALOX15
Orthocresol SCHEMBL28383837 0.80 TRPA1 (0.46) CYP3A4TDP1GAAHSD11B1ALOX15
Trifluoromethanesulfonic Acid SCHEMBL27550262 0.79 FDPS (0.42) GAAHSD11B1ALOX15TSHRCA1
O-Tolylamine SCHEMBL1686216 0.78 TDP1 (0.58) CYP3A4TDP1CD44GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102702278-B Method for synthesizing clindamycin 3,4-isopropylidene UNIV ZHEJIANG TECHNOLOGY 2015-01-28 CN claimed
CN-102702278-A Method for synthesizing clindamycin 3,4-isopropylidene UNIV ZHEJIANG TECHNOLOGY 2012-10-03 CN claimed
CN-102702278-B Method for synthesizing clindamycin 3,4-isopropylidene UNIV ZHEJIANG TECHNOLOGY 2015-01-28 CN disclosed
CN-102702278-A Method for synthesizing clindamycin 3,4-isopropylidene UNIV ZHEJIANG TECHNOLOGY 2012-10-03 CN disclosed
US-20070048660-A1 Resist composition, method for forming resist pattern, semiconductor device and method for manufacturing thereof FUJITSU LIMITED (JP) 2007-03-01 US disclosed
EP-1757983-A1 Resist composition, method for forming resist pattern, semiconductor device and method for manufacturing thereof Fujitsu Ltd. (JP) 2007-02-28 EP disclosed