SCHEMBL514306

SCHEMBL514306

O=CNc1ccccc1F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.50
SMN1; SMN2 Q16637 5/20 0.50
NPC1 O15118 5/20 0.50
ALDH1A1 P00352 5/20 0.49
TSHR P16473 1/20 0.47
MAPT P10636 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
NFKB1 P19838 2/20 0.45
NFKB2 Q00653 2/20 0.45
RELA Q04206 2/20 0.45
KDM4E B2RXH2 1/20 0.45
PSIP1 O75475 1/20 0.44
TP53 P04637 1/20 0.44
PKM P14618 1/20 0.44
EGFR P00533 1/20 0.42
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
HTT P42858 2/20 0.41

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
SCHEMBL2090488 0.82 TSHR (0.40) RAB9ASMN1; SMN2NPC1ALDH1A1TSHR
SCHEMBL8763290 0.82 ALDH1A1 (0.57) RAB9ASMN1; SMN2NPC1ALDH1A1TSHR
SCHEMBL30527294 0.82 ALDH1A1 (0.57) RAB9ASMN1; SMN2NPC1ALDH1A1TSHR
SCHEMBL3333781 0.79 TSHR (0.38) RAB9ASMN1; SMN2NPC1ALDH1A1TSHR
SCHEMBL2092487 0.79 SMN1; SMN2 (0.46) RAB9ASMN1; SMN2NPC1ALDH1A1TSHR
SCHEMBL27834680 0.77 SMN1; SMN2 (0.42) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL3166136 0.76 SMN1; SMN2 (0.45) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL27551601 0.76 RAB9A (0.45) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL12420965 0.74 ERN1 (0.39) RAB9ASMN1; SMN2NPC1ALDH1A1TSHR
SCHEMBL8967636 0.74 PABPC1 (0.53) RAB9ASMN1; SMN2NPC1ALDH1A1TSHR

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 197 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118598766-A Method for preparing C-7-formamido substituted p-methylene quinone compound 湖南理工学院 2024-09-06 CN claimed
CN-111662185-B Synthesis method of N-methyl o-fluoroaniline 江苏富鼎化学有限公司 2023-05-05 CN claimed
CN-113429297-A Method for synthesizing N-methyl o-fluoroaniline by one-pot method 江西汇和化工有限公司 2021-09-24 CN claimed
CN-111662185-A Synthesis method of N-methyl o-fluoroaniline 江苏富鼎化学有限公司 2020-09-15 CN claimed
EP-2513054-B1 BICYCLIC DERIVATIVES USEFUL AS INHIBITORS OF DPP-1 JANSSEN PHARMACEUTICA NV (BE) 2016-03-09 EP claimed
US-20110046368-A1 LIGANDS OF 5-HT6 RECEPTORS, A PHARMACEUTICAL COMPOSITION, METHOD FOR THE PRODUCTION AND USE THEREOF IVASHCHENKO ANDREY ALEXANDROVICH 2011-02-24 US claimed
EP-2184064-A2 LIGANDS OF 5-HT6 RECEPTORS, A PHARMACEUTICAL COMPOSITION, METHOD FOR THE PRODUCTION AND USE THEREOF Alla Chem, LLC. (US) 2010-05-12 EP claimed
US-20050227974-A9 Aminoalkyl-substituted aryl compounds and their use as sodium channel blockers EURO-CELTIQUE S.A. 2005-10-13 US claimed
EP-1525194-A1 AMINOALKYL-SUBSTITUTED ARYL COMPOUNDS AND THEIR USE AS SODIUM CHANNEL BLOCKERS Euro-Celtique S.A. (LU) 2005-04-27 EP claimed
US-20040116415-A1 Aminoalkyl-substituted aryl compounds and their use as sodium channel blockers EURO-CELTIQUE S.A. 2004-06-17 US claimed
WO-2004013114-A1 AMINOALKYL-SUBSTITUTED ARYL COMPOUNDS AND THEIR USE AS SODIUM CHANNEL BLOCKERS EURO-CELTIQUE S.A. (LU) 2004-02-12 WO claimed
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP claimed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US claimed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO claimed
CN-118598766-A Method for preparing C-7-formamido substituted p-methylene quinone compound 湖南理工学院 2024-09-06 CN disclosed
WO-2024071216-A1 PYRAZOLE COMPOUND AND PEST CONTROL AGENT CONTAINING SAME AS ACTIVE INGREDIENT 三井化学クロップ&ライフソリューション株式会社 2024-04-04 WO disclosed
WO-2023210623-A1 HALOALKYL SULFONE ANILIDE COMPOUND AND HERBICIDE CONTAINING SAME 株式会社エス・ディー・エス バイオテック 2023-11-02 WO disclosed
US-4272551-A N-Sulfenylated formanilides useful as fungicides and bactericides BASF AKTIENGESELLSCHAFT (DE) 1981-06-09 US disclosed
EP-0008731-B1 N-SULFENYL FORMANILIDES, THEIR PREPARATION AND THEIR USE AS FUNGICIDES BASF Aktiengesellschaft (DE) 1981-05-13 EP disclosed
EP-0008731-A1 N-sulfenyl formanilides, their preparation and their use as fungicides BASF Aktiengesellschaft (DE) 1980-03-19 EP 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 (2 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-20050227974-A9 Aminoalkyl-substituted aryl compounds and their use as sodium channel blockers KCNN3, CACNA1S, CACNA1C RAB9A 3212/4885SMN1; SMN2 107/4885NPC1 1139/4885
US-20110046368-A1 LIGANDS OF 5-HT6 RECEPTORS, A PHARMACEUTICAL COMPOSITION, METHOD FOR THE PRODUCTION AND USE THEREOF HTR6, HTR1A, HTR3B RAB9A 4005/4885SMN1; SMN2 1856/4885NPC1 2178/4885

“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.