SCHEMBL3670168

SCHEMBL3670168

CC(C)(C)c1ccc(CI)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
APP P05067 1/20 0.47
LMNA P02545 1/20 0.46
TYR P14679 1/20 0.46
KCNH2 Q12809 1/20 0.45
TP53 P04637 1/20 0.45
BCHE P06276 4/20 0.45
ACHE P22303 4/20 0.45
SIGMAR1 Q99720 1/20 0.40
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
ADRA1D P25100 1/20 0.40
HTR1D P28221 1/20 0.40
HTR1B P28222 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40
KIF11 P52732 1/20 0.39
EPHX2 P34913 4/20 0.39
NR1H4 Q96RI1 3/20 0.39

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
SCHEMBL18724490 0.93 KIF11 (0.50) TSHRAPPLMNATYRKCNH2
SCHEMBL14838173 0.82 KCNH2 (0.53) TSHRAPPLMNATYRKCNH2
SCHEMBL26214735 0.80 ESR1 (0.39) TSHRAPPLMNATYR
SCHEMBL1006929 0.79 TSHR (0.50) TSHRAPPLMNATYRKCNH2
SCHEMBL14479518 0.78 NPC1 (0.46) APPLMNAKCNH2
SCHEMBL7456580 0.78 KCNH2 (0.59) TSHRLMNATYRKCNH2TP53
SCHEMBL348623 0.78 TSHR (0.52) TSHRAPPLMNATYRKCNH2
SCHEMBL12747106 0.77 TP53 (0.36) TSHRAPPTP53
SCHEMBL424728 0.76 TSHR (0.73) TSHRLMNATYRBCHEACHE
SCHEMBL649682 0.76 ALDH1A1 (0.37) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117979716-A Perovskite photoelectric detector for picosecond light detection and ranging and preparation method thereof 苏州大学 2024-05-03 CN claimed
CN-118702853-A Method for terminating anion polymerization and removing initiator 青岛玄道科技有限公司 2024-09-27 CN disclosed
CN-117979716-A Perovskite photoelectric detector for picosecond light detection and ranging and preparation method thereof 苏州大学 2024-05-03 CN disclosed
US-11174282-B2 Aminosteroid derivatives and process for producing same UNIVERSITé LAVAL (CA) 2021-11-16 US disclosed
WO-2016202894-A1 METHOD OF CONVERTING ALCOHOL TO HALIDE UNIVERSITAET DES SAARLANDES (DE) 2016-12-22 WO disclosed
WO-2015025962-A1 AMIDINE COMPOUND OR SALT THEREOF 富山化学工業株式会社 (JP) 2015-02-26 WO disclosed
US-20120164031-A1 FLUORESCENCE QUENCHING BASED OXYGEN SENSOR HONEYWELL INTERNATIONAL INC. (US) 2012-06-28 US disclosed
EP-2139901-A1 ORGANIC SEMICONDUCTORS Merck Patent GmbH (DE) 2010-01-06 EP disclosed
WO-2008131835-A1 ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2008-11-06 WO disclosed
US-20030139600-A1 2-pyridylsilane, processes for producing and using the same SUMITOMO CHEMICAL CO., LTD. 2003-07-24 US disclosed
US-6548673-B1 Alkylation using transition metal complex catalyst; purified by acid/base extraction SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-04-15 US disclosed
US-6531602-B2 Desilylation of a 2-pyridylsilane to form an alcohol SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-11 US disclosed
US-20020165397-A1 2-Pyridylsilane, processes for producing and using the same SUMITOMO CHEMICAL CO., LTD. 2002-11-07 US disclosed
EP-1035125-A2 2-Pyridylsilane, processes for producing and using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-09-13 EP disclosed
US-4420437-A Preparation of a 2-aralkyl-5,5-dialkyl-1,3,2-dioxaphosphorinan-2-one from 2-aralkoxy-5,5-dialkyl-1,3,2-dioxaphosphorinane WITCO CHEMICAL CORPORATION (US) 1983-12-13 US 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 (3 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-20020165397-A1 2-Pyridylsilane, processes for producing and using the same H1-0, RIOK2, H1-4 TSHR 1511/4885APP 4045/4885LMNA 2432/4885
US-20030139600-A1 2-pyridylsilane, processes for producing and using the same H1-0, H1-4, H1-2 TSHR 1430/4885APP 4055/4885LMNA 2555/4885
US-11174282-B2 Aminosteroid derivatives and process for producing same HSD17B11, HSD17B7, CYP19A1 TSHR 2137/4885APP 1173/4885LMNA 3630/4885

“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.