SCHEMBL28548702

SCHEMBL28548702

Nc1cccc(-c2cc(N)ccc2-c2ccccc2C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.53
POLB P06746 2/20 0.53
GLA P06280 1/20 0.53
GAA P10253 1/20 0.53
SCN9A Q15858 3/20 0.43
BACE1 P56817 1/20 0.43
MAOA P21397 1/20 0.43
PTPRC P08575 2/20 0.42
NPC1 O15118 2/20 0.42
ALDH1A1 P00352 2/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TOP2A P11388 1/20 0.42
MEN1 O00255 1/20 0.42
APAF1 O14727 1/20 0.42
TDP2 O95551 1/20 0.42
NSD2 O96028 1/20 0.42
LMNA P02545 1/20 0.42
PLA2G1B P04054 1/20 0.42
CTSL P07711 1/20 0.42

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
SCHEMBL28912663 0.94 TSHR (0.53) TSHRPOLBGLAGAASCN9A
SCHEMBL3398486 0.89 SCN9A (0.53) TSHRPOLBGLAGAASCN9A
SCHEMBL5851670 0.87 TSHR (0.64) TSHRPOLBGLAGAABACE1
SCHEMBL29518230 0.87 TSHR (0.64) TSHRPOLBGLAGAABACE1
SCHEMBL29836728 0.87 TSHR (0.64) TSHRPOLBGLAGAABACE1
SCHEMBL672246 0.85 TSHR (0.52) TSHRPOLBGLAGAASCN9A
SCHEMBL3804592 0.82 TSHR (0.68) TSHRPOLBGLAGAASCN9A
SCHEMBL8143935 0.81 TSHR (0.80) TSHRPOLBGLAGAABACE1
SCHEMBL28381351 0.81 TSHR (0.56) TSHRPOLBGLAGAASCN9A
SCHEMBL3783934 0.80 MAP4K4 (0.46) TSHRPOLBGLAGAASCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115011116-A Polyimide film 株式会社斗山 2022-09-06 CN disclosed
CN-114854196-A Polyimide film 株式会社斗山 2022-08-05 CN disclosed
CN-113260676-A Polyimide film having excellent weather resistance 株式会社斗山 2021-08-13 CN disclosed
CN-113260675-A Polyimide film having excellent yield strain and bending characteristics 株式会社斗山 2021-08-13 CN disclosed
CN-113260658-A Polyamic acid composition and transparent polyimide film using same 株式会社斗山 2021-08-13 CN disclosed
CN-108431088-B Polyamic acid solution using diamine monomer and polyimide film comprising same 株式会社斗山 2021-04-06 CN disclosed
CN-110892002-A Method for producing polyamic acid resin having ease of laser peeling and high heat resistance, and polyimide film produced by using same 大林有限公司 2020-03-17 CN disclosed