SCHEMBL18375770

SCHEMBL18375770

CC(C)(C)CC(C)(C)c1cc(Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(O)c(-n2nc3ccccc3n2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
P2RX1 P51575 4/20 0.35
TAS2R14 Q9NYV8 6/20 0.34
P2RX7 Q99572 3/20 0.33
P2RX4 Q99571 2/20 0.33
POLB P06746 1/20 0.33
TMPRSS4 Q9NRS4 1/20 0.33
LMNA P02545 1/20 0.33
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
P2RX3 P56373 1/20 0.32
MET P08581 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
MDH1 P40925 1/20 0.31
MDH2 P40926 1/20 0.31

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
SCHEMBL29895632 1.00 PIK3CG (0.36) PIK3CGNPC1RAB9AP2RX1TAS2R14
SCHEMBL20349986 0.88 NPC1 (0.39) NPC1RAB9APOLBLMNAMAPT
SCHEMBL18375844 0.88 NPC1 (0.42) NPC1RAB9APOLBLMNAMAPT
SCHEMBL29895932 0.88 NPC1 (0.42) NPC1RAB9APOLBLMNAMAPT
SCHEMBL20337194 0.86 PIK3CG (0.35) PIK3CGTAS2R14P2RX7POLBLMNA
SCHEMBL105359 0.84 NPC1 (0.39) NPC1RAB9APOLBLMNAMAPT
SCHEMBL20337191 0.83 NPC1 (0.32) NPC1RAB9APOLBMAPTIDH1
SCHEMBL18374917 0.82 NPC1 (0.41) NPC1RAB9APOLBLMNATP53
SCHEMBL28467025 0.79 ACLY (0.36) MAPT
SCHEMBL17941213 0.78 MAPK14 (0.40) NPC1RAB9APOLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108026327-B Polymer matrix with ionic additives 3M创新有限公司 2022-07-05 CN disclosed
EP-3319947-B1 SUBSTITUTED BENZOTRIAZOLE PHENOLS 3M INNOVATIVE PROPERTIES CO (US) 2022-05-04 EP disclosed
CN-108026054-B Substituted benzotriazolols 3M创新有限公司 2021-10-15 CN disclosed
US-11078419-B2 Substituted benzotriazole phenolate salts and antioxidant compositions formed therefrom 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-08-03 US disclosed
US-11053373-B2 Polymeric matrices with ionic additives 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-07-06 US disclosed
EP-3320055-B1 SUBSTITUTED BENZOTRIAZOLE PHENOLATE SALTS AND ANTIOXIDANT COMPOSITIONS FORMED THEREFROM 3M INNOVATIVE PROPERTIES CO (US) 2021-03-03 EP disclosed
US-10919867-B2 Substituted benzotriazole phenols 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-02-16 US disclosed
US-10919867-B2 Substituted benzotriazole phenols 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-02-16 US disclosed
CN-107849449-B Substituted benzotriazole phenolates and antioxidant compositions formed therefrom 3M创新有限公司 2020-12-29 CN disclosed
CN-108026679-B Electret webs with charge-enhancing additives 3M创新有限公司 2020-10-16 CN disclosed
US-10724171-B2 Electret webs with charge-enhancing additives 3M INNOVATIVE PROPERTIES COMPANY (US) 2020-07-28 US disclosed
US-20200172809-A1 SUBSTITUTED BENZOTRIAZOLE PHENOLATE SALTS AND ANTIOXIDANT COMPOSITIONS FORMED THEREFROM 3M INNOVATIVE PROPERTIES CO (US) 2020-06-04 US disclosed
US-10669481-B2 Substituted benzotriazole phenolate salts and antioxidant compositions formed therefrom 3M INNOVATIVE PROPERTIES COMPANY (US) 2020-06-02 US disclosed
EP-3320135-B1 ELECTRET WEBS WITH CHARGE-ENHANCING ADDITIVES 3M INNOVATIVE PROPERTIES CO (US) 2019-08-28 EP disclosed
US-20190003112-A1 ELECTRET WEBS WITH CHARGE-ENHANCING ADDITIVES 3M INNOVATIVE PROPERTIES COMPANY 2019-01-03 US disclosed
US-20180195000-A1 SUBSTITUTED BENZOTRIAZOLE PHENOLATE SALTS AND ANTIOXIDANT COMPOSITIONS FORMED THEREFROM 3M INNOVATIVE PROPERTIES COMPANY 2018-07-12 US disclosed
US-20180186757-A1 SUBSTITUTED BENZOTRIAZOLE PHENOLS 3M INNOVATIVE PROPERTIES COMPANY 2018-07-05 US disclosed
US-20180186757-A1 SUBSTITUTED BENZOTRIAZOLE PHENOLS 3M INNOVATIVE PROPERTIES COMPANY 2018-07-05 US disclosed
WO-2017007677-A1 SUBSTITUTED BENZOTRIAZOLE PHENOLATE SALTS AND ANTIOXIDANT COMPOSITIONS FORMED THEREFROM 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-01-12 WO disclosed
WO-2017007673-A1 POLYMERIC MATRICES WITH IONIC ADDITIVES 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-01-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180186757-A1 SUBSTITUTED BENZOTRIAZOLE PHENOLS TYR, COMT, TH PIK3CG 2995/4885NPC1 4473/4885RAB9A 4635/4885
US-20200172809-A1 SUBSTITUTED BENZOTRIAZOLE PHENOLATE SALTS AND ANTIOXIDANT COMPOSITIONS FORMED THEREFROM COMT, OGFOD1, TYR PIK3CG 3047/4885NPC1 4227/4885RAB9A 4875/4885
US-10919867-B2 Substituted benzotriazole phenols TYR, COMT, TH PIK3CG 2995/4885NPC1 4473/4885RAB9A 4635/4885
US-10669481-B2 Substituted benzotriazole phenolate salts and antioxidant compositions formed therefrom COMT, OGFOD1, TYR PIK3CG 3047/4885NPC1 4227/4885RAB9A 4875/4885
US-11078419-B2 Substituted benzotriazole phenolate salts and antioxidant compositions formed therefrom COMT, OGFOD1, TYR PIK3CG 3047/4885NPC1 4227/4885RAB9A 4875/4885
US-20180195000-A1 SUBSTITUTED BENZOTRIAZOLE PHENOLATE SALTS AND ANTIOXIDANT COMPOSITIONS FORMED THEREFROM COMT, OGFOD1, TYR PIK3CG 3047/4885NPC1 4227/4885RAB9A 4875/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.