Pyridine

Pyridine

SCHEMBL9828025

C[Si](C)(C)NC(=O)C(F)(F)F.c1ccncc1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.35
TSHR P16473 1/20 0.35
NAPRT Q6XQN6 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PLOD2 O00469 2/20 0.33
PLOD3 O60568 2/20 0.33
PLOD1 Q02809 2/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CA2 P00918 1/20 0.33
KDM4E B2RXH2 2/20 0.31
MAPK8 P45983 1/20 0.30
MAPK10 P53779 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
SCHEMBL248291 0.83 CA2 (0.46) L3MBTL1MEN1NPC1TP53RAB9A
Water SCHEMBL27649766 0.81 CA2 (0.43) L3MBTL1MEN1KMT2ACA2
SCHEMBL7209299 0.77 CA2 (0.40) L3MBTL1MEN1KMT2ACA2
Pyridine SCHEMBL28868409 0.74 NAPRT (0.45) L3MBTL1TSHRNAPRTTDP1PLOD2
Trifluoroacetic Acid SCHEMBL9068482 0.74 NAPRT (0.50) L3MBTL1TSHRNAPRTTDP1PLOD2
Trifluoroacetic Acid SCHEMBL158703 0.74 NAPRT (0.50) L3MBTL1TSHRNAPRTTDP1PLOD2
Trifluoroacetic Acid SCHEMBL16824180 0.74 NAPRT (0.50) L3MBTL1TSHRNAPRTTDP1PLOD2
Pyridine SCHEMBL5316497 0.72 KCNN4 (0.39) L3MBTL1TSHRNAPRTTDP1PLOD2
Trifluoroacetic Acid SCHEMBL6076010 0.72 NAPRT (0.47) L3MBTL1TSHRNAPRTTDP1PLOD2
Trifluoroacetic Acid SCHEMBL27559395 0.72 NAPRT (0.47) L3MBTL1TSHRNAPRTTDP1PLOD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103380105-B P-phthalic acid and the production method of terephthalate 陶氏环球技术有限责任公司 2016-08-10 CN disclosed
CN-1159284-C Aminomethylation of tocopherols DSM IP �ʲ����޹�˾ 2004-07-28 CN disclosed
CN-1138026-A Aminomethylation of tocopherols HOFFMANN LA ROCHE (CH) 1996-12-18 CN disclosed
EP-0261248-B1 $g(a), $g(a)-TREHALOSE TRIMYCOLATE AND MEDICINAL COMPOSITION SAWAI PHARMACEUTICAL CO., LTD. (JP) 1991-05-29 EP disclosed